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- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 35 families. | |||||
1 | 5NLK | Kd = 0.035 uM | 92E | C24 H23 N3 O6 | CCOc1ccc(c.... |
2 | 5MQE | Kd = 4 uM | PKU | C6 H7 Br N2 O | CNC(=O)c1c.... |
3 | 4YK0 | Kd = 181 uM | 098 | C24 H29 N3 O5 | c1ccc2c(c1.... |
4 | 5MPZ | Kd = 85 uM | 4I8 | C9 H7 N O4 | COC(=O)c1c.... |
5 | 6AXQ | ic50 = 99000 nM | C2Y | C10 H9 N O2 | COC(=O)c1c.... |
6 | 5DBM | Kd = 0.35 uM | 58N | C17 H22 N4 O | C[C@@H]1CC.... |
7 | 5LPM | Kd = 2.77 uM | 71Y | C20 H23 Cl N2 O3 | CCc1c(c([n.... |
8 | 5NRW | - | 96N | C21 H22 N2 O2 | CCc1c(c([n.... |
9 | 3P1D | - | MB3 | C5 H9 N O | CN1CCCC1=O |
10 | 5LPJ | Kd = 10.1 uM | XDM | C17 H19 Cl N2 O2 | CCc1c(c([n.... |
11 | 6FQO | ic50 = 0.14 uM | E2T | C26 H24 N2 O6 | CCOc1ccc(c.... |
12 | 4TQN | Kd = 0.77 uM | UL4 | C18 H17 N O5 | CCOc1ccc(c.... |
13 | 6FRF | ic50 = 0.04 uM | E3T | C26 H24 N2 O5 | CCOc1ccc(c.... |
14 | 5TB6 | Kd = 1.53 uM | 77X | C15 H17 N3 O | CCC(=O)N1C.... |
15 | 5MQK | - | QPR | C11 H11 N O | CC(=O)c1cn.... |
16 | 5MQG | - | F31 | C9 H11 N O2 | CC(=O)c1cc.... |
17 | 5I83 | ic50 = 4.1 uM | 68Y | C18 H20 N2 O2 | C[C@@H]1CC.... |
18 | 4A9K | - | TYL | C8 H9 N O2 | CC(=O)Nc1c.... |
19 | 5I86 | ic50 = 0.53 uM | 69A | C18 H19 N3 O2 | C[C@@H]1CC.... |
20 | 6FR0 | ic50 = 0.146 uM | E3H | C27 H26 N2 O6 | CCN1C(=O)C.... |
21 | 5NU5 | Kd = 0.47 uM | 99E | C21 H22 N2 O4 | CCc1c(c([n.... |
22 | 5LPK | Kd = 3.06 uM | XDM | C17 H19 Cl N2 O2 | CCc1c(c([n.... |
23 | 5MME | Kd = 1.4 uM | 8Q6 | C20 H21 N O6 | CCOc1ccc(c.... |
24 | 5I89 | ic50 = 0.033 uM | 69B | C21 H22 N4 O | C[C@@H]1CC.... |
25 | 5NU3 | Kd = 0.23 uM | 99E | C21 H22 N2 O4 | CCc1c(c([n.... |
26 | 5OWK | - | 7MX | C9 H10 Cl N O3 | CCOC(=O)C1.... |
27 | 6AY5 | ic50 = 69 nM | C3V | C22 H20 F2 N4 O S | Cn1cc(cn1).... |
28 | 5LPL | Kd = 12 uM | 71X | C20 H23 Cl N2 O3 | CCc1c(c([n.... |
29 | 6FQU | ic50 = 2.2 uM | E3B | C21 H23 F2 N O2 | CCOc1ccc(c.... |
30 | 6DMK | - | 2LL | C26 H30 N4 O2 | Cc1c(c(on1.... |
31 | 5MMG | Kd = 0.97 uM | UT0 | C19 H20 N2 O4 S | CCOc1ccc(c.... |
32 | 5MPN | Kd = 0.085 uM | YE5 | C17 H16 N4 O2 | CCOc1ccc(c.... |
33 | 5J0D | Kd = 134 nM | 6F9 | C27 H35 N3 O5 | CCC(=O)N1C.... |
34 | 6AY3 | ic50 = 9.5 nM | C3J | C24 H23 F2 N5 O | CNC(=O)c1c.... |
35 | 5MPK | Kd = 0.003 uM | 0BC | C21 H18 N6 O3 S | CCOc1ccc(c.... |
36 | 5CGP | Kd = 0.12 uM | 53W | C27 H32 N4 O3 | Cc1c(c(on1.... |
37 | 5XXH | ic50 = 6.8 uM | E0D | C18 H20 N2 O4 | CC(=O)c1cn.... |
38 | 5W0L | ic50 = 1.1 nM | 9UD | C27 H32 F2 N6 O2 | CC(=O)N1CC.... |
39 | 5W0F | ic50 = 16 nM | 9U7 | C25 H30 N6 O2 | CC(=O)N1CC.... |
40 | 5W0E | ic50 = 0.94 nM | 9U4 | C27 H33 F2 N7 O2 | CNC(=O)N1C.... |
41 | 5W0Q | ic50 = 18 uM | 9UG | C12 H16 N2 O2 | Cc1ccc2c(c.... |
42 | 5W0I | ic50 = 1.4 nM | 9UA | C26 H30 F2 N6 O2 | CC(=O)N1CC.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1144 families. | |||||
1 | 6JJ3 | ic50 = 100 nM | BS6 | C23 H25 N5 O4 S | CN1CCN(CC1.... |
2 | 6P05 | ic50 = 5.9 nM | YF2 | C30 H28 N6 O3 S | CCS(=O)(=O.... |
3 | 4IOO | - | BAE | C6 H13 N O | CC(C)(C)C(.... |
4 | 5I88 | Kd = 250 nM | 69G | C20 H21 N3 O2 | C/C=C/CN1C.... |
5 | 5DX4 | Kd = 0.137 uM | E0C | C20 H17 Br N2 O4 S | CCN1c2ccc(.... |
6 | 6JJB | ic50 = 49.5 nM | BT0 | C19 H16 N2 O4 S | CN1c2ccc(c.... |
7 | 3JVK | Kd = 118 uM | GLY GLY ALY ALA PRO ARG LYS GLN | n/a | n/a |
8 | 4HBX | ic50 = 1.9 uM | 14X | C13 H17 N3 O3 S | CN1Cc2cc(c.... |
9 | 4NUE | Ki = 0.15 uM | NUE | C19 H19 N5 O3 S | Cc1cc(c(c(.... |
10 | 6SB8 | Kd = 0.07 uM | L45 | C21 H27 N3 O5 S | CCN(CC)S(=.... |
11 | 5Y94 | Kd = 164 nM | 8QC | C16 H16 Br N3 O4 S | Cc1c2cc(c(.... |
12 | 6DMJ | - | 53W | C27 H32 N4 O3 | Cc1c(c(on1.... |
13 | 4HXR | ic50 = 4.1 uM | 1A4 | C13 H10 N2 O3 S3 | c1cc(cc(c1.... |
14 | 6DML | - | 9BM | C25 H26 N4 O4 | Cc1c(c(on1.... |
15 | 5TI5 | ic50 = 41 uM | 7CN | C16 H13 Br N2 O3 S | c1cc(cc(c1.... |
16 | 6VUJ | ic50 = 35.2 uM | RLY | C23 H30 N2 O5 S | CCN(CC)S(=.... |
17 | 6X7B | ic50 = 27 nM | ZVP | C26 H24 N4 O5 S | c1cc(cnc1).... |
18 | 4O7C | ic50 = 10 uM | 2RK | C22 H23 N5 O | C1CNCCC1C2.... |
19 | 4IOQ | - | BAQ | C4 H7 N O | C1CC(=O)NC.... |
20 | 4HXK | - | 1AJ | C11 H11 N3 O S | c1csc2c1CN.... |
21 | 6S6K | Kd = 0.18 uM | KXK | C24 H31 N3 O5 S | Cc1c2c(c([.... |
22 | 2YEL | ic50 = 15.5 nM | WSH | C25 H21 N5 O2 | Cc1nnc2n1-.... |
23 | 6RWJ | Kd = 6.41 uM | KLK | C12 H16 N2 O2 | Cc1c2c(c([.... |
24 | 6SA2 | Kd = 0.08 uM | L25 | C22 H27 N3 O6 S | Cc1c2c(c([.... |
25 | 6XV7 | - | O2Q | C14 H13 F2 N5 | Cc1nnc2n1n.... |
26 | 4BW4 | ic50 = 631 nM | 9B6 | C22 H16 F3 N5 O4 | Cc1c(c(on1.... |
27 | 4O72 | ic50 = 1 uM | 2R4 | C25 H19 N O3 S | c1ccc2c(c1.... |
28 | 5F63 | Kd = 12 nM | 5W2 | C28 H35 Cl F N7 O3 S | Cc1cnc(nc1.... |
29 | 5HLS | ic50 = 0.039 uM | 62G | C20 H16 Cl N3 O2 | Cc1c-2c(on.... |
30 | 4HBW | ic50 = 4.8 uM | 14Z | C11 H15 N3 O3 S | CCNS(=O)(=.... |
31 | 4OGI | Kd = 37 nM | R78 | C28 H39 N7 O3 | CC[C@@H]1C.... |
32 | 6WW8 | - | YR0 | C31 H32 N6 O4 S | CN(C)C(=O).... |
33 | 5TI7 | ic50 = 11 uM | 7CQ | C17 H19 Br N2 O4 S | COc1ccc(cc.... |
34 | 4J0S | ic50 = 0.382 uM | 1H3 | C18 H17 N O3 | Cc1c(c(on1.... |
35 | 6Q3Y | Kd = 54 nM | HG5 | C30 H38 N6 O2 | CC[C@@H]1C.... |
36 | 6SAJ | Kd = 0.05 uM | L2Z | C23 H27 N3 O6 S | Cc1c2c(c([.... |
37 | 4F3I | Kd = 36.1 nM | 0S6 | C20 H19 Cl N4 O2 S | Cc1c(sc-2c.... |
38 | 4QZS | Kd = 89 nM | JQ1 | C23 H26 Cl N4 O2 S | Cc1c(sc-2c.... |
39 | 6AFR | ic50 = 70 nM | 9E3 | C13 H10 F N3 O | c1cc2c(ccc.... |
40 | 4WIV | Kd = 550 nM | 3P2 | C21 H23 N5 O | Cc1c(c(on1.... |
41 | 6VUF | ic50 = 147 uM | RLV | C14 H20 N2 O3 S | CCCNS(=O)(.... |
42 | 3P5O | Kd = 55.2 nM | EAM | C22 H22 Cl N5 O2 | CCNC(=O)C[.... |
43 | 4UIX | ic50 = 0.00000001 M | TVU | C22 H24 N2 O6 S2 | CN1C=C(c2c.... |
44 | 4HXS | ic50 = 4.1 uM | 1A3 | C16 H14 N2 O3 S2 | c1ccc(cc1).... |
45 | 5HM0 | ic50 = 0.44 uM | 62V | C18 H13 Cl N2 O | Cc1c-2c(on.... |
46 | 5DLX | Kd = 2 uM | 5D2 | C25 H33 Cl N8 O | Cc1nnc2n1n.... |
47 | 5TI2 | ic50 = 24 uM | 7CJ | C16 H15 F N2 O3 S | c1cc(cc(c1.... |
48 | 5D3H | Kd = 7.9 uM | 57G | C20 H27 N3 O6 S | CCc1c(c([n.... |
49 | 6E4A | Kd = 44 nM | HRY | C29 H34 Cl N7 O | CN1C=C(C=C.... |
50 | 4MEP | ic50 = 4.7 uM | 24Y | C19 H14 Cl N5 O | Cc1cccnc1n.... |
51 | 4YH4 | ic50 = 26 uM | Y81 | C20 H15 N3 O2 | c1ccc(cc1).... |
52 | 5D3N | Kd = 9.2 uM | L40 | C18 H23 N3 O4 S | CCc1c(c([n.... |
53 | 6C7R | Kd = 2.2 nM | EO4 | C24 H25 N7 O2 | Cc1c(c(on1.... |
54 | 6WGX | ic50 = 0.15 uM | U0D | C31 H36 F3 N7 | Cc1cc(cc(c.... |
55 | 6HOV | - | FER | C10 H10 O4 | COc1cc(ccc.... |
56 | 5D26 | Kd = 0.81 uM | L28 | C19 H26 N4 O5 S | CCc1c(c([n.... |
57 | 3MUK | Kd = 380 uM | ALA THR PRK ALA ALA ARG LYS SER | n/a | n/a |
58 | 4J3I | Kd = 8.93 uM | 1K0 | C20 H22 N2 O5 | Cc1cc(cc(c.... |
59 | 6X7D | ic50 = 388 nM | UT4 | C19 H18 N2 O4 S | c1cc2c(cc1.... |
60 | 4QB3 | Kd = 3.4 uM | 30M | C17 H21 N3 O2 | CC(=O)NCCC.... |
61 | 4LZS | Kd = 16 uM | L46 | C11 H16 N2 O2 | CCc1c(c([n.... |
62 | 6HDQ | ic50 = 5.01 uM | FZE | C30 H37 F2 N5 O | Cc1cc(cnc1.... |
63 | 4O71 | ic50 = 18 uM | CPB | C21 H20 Cl N O5 | C[N@]1CC[C.... |
64 | 4CFL | Kd = 1.33 uM | 8DQ | C19 H18 N2 O2 | c1ccc(cc1).... |
65 | 4C67 | - | L5S | C15 H12 N4 S | Cc1nnc2n1-.... |
66 | 6V1K | - | 5SW | C20 H23 N3 O3 | CN1C=C(c2c.... |
67 | 4QR3 | ic50 = 1.4 uM | BNJ | C14 H16 N2 O3 S2 | c1cc(cc(c1.... |
68 | 4ZC9 | - | 4MW | C38 H37 Cl N8 O7 S | Cc1c(sc-2c.... |
69 | 4MEO | - | 25V | C18 H16 N2 O2 | Cc1cc(c2cc.... |
70 | 6UVM | Kd = 510 uM | QJA | C11 H13 N O S2 | CC(=O)N1CC.... |
71 | 4LRG | ic50 = 0.026 uM | 1XB | C20 H18 Cl N3 O2 S | Cc1c(sc-2c.... |
72 | 6CKS | ic50 = 0.015 uM | F5Y | C23 H23 N3 O4 S | CCS(=O)(=O.... |
73 | 6DJC | Ki = 232.8 nM | CF6 | C48 H54 Cl2 N10 O2 S2 | Cc1c(sc-2c.... |
74 | 5TI3 | ic50 = 44 uM | 7CG | C16 H14 Br2 N2 O3 S | c1cc(cc(c1.... |
75 | 4HXP | - | 1A5 | C10 H10 N2 O3 | c1cc(ccc1C.... |
76 | 6PSB | ic50 = 24 uM | Y18 | C17 H19 N3 O2 | CN1C[C@H](.... |
77 | 6CD4 | ic50 = 5.14 uM | EX1 | C33 H42 N8 O3 | CC(C)N1c2c.... |
78 | 4O7E | ic50 = 5.7 uM | 2RN | C20 H15 N3 O | c1ccc(cc1).... |
79 | 4O74 | ic50 = 0.025 uM | R78 | C28 H39 N7 O3 | CC[C@@H]1C.... |
80 | 4BW2 | ic50 = 6.31 uM | UTH | C24 H24 N4 O3 | Cc1c(c(on1.... |
81 | 5CS8 | ic50 = 2.29 uM | EB8 | C21 H18 N2 O5 S | CCN1c2ccc(.... |
82 | 3U5J | Kd = 2.46 uM | 08H | C17 H13 Cl N4 | Cc1nnc2n1-.... |
83 | 5EIS | Kd = 1.8 uM | 5OU | C14 H13 Cl N4 O2 | CCn1cnc2c1.... |
84 | 6FO5 | Kd = 0.19 uM | DZH | C25 H26 N6 O5 S | CCn1cnc2c1.... |
85 | 6V1L | Kd = 418 nM | 5U6 | C20 H23 N3 O3 | CN1C=C(c2c.... |
86 | 3U5L | Kd = 0.64 uM | 08K | C17 H14 Cl N5 | Cc1nnc2n1-.... |
87 | 4QR4 | ic50 = 0.25 uM | BNK | C14 H15 Cl N2 O3 S2 | c1cc(c(cc1.... |
88 | 4O7A | ic50 = 19 uM | 2RF | C16 H10 Cl2 N2 O3 | c1cc(cc(c1.... |
89 | 5F61 | Kd = 35 nM | 5W0 | C26 H34 F N7 O2 S | Cc1cnc(nc1.... |
90 | 4HXN | - | 1A7 | C9 H6 F N O S | c1ccc(c(c1.... |
91 | 6DL2 | Ki = 33 nM | GUJ | C17 H17 N3 O S | Cc1c(c2c(s.... |
92 | 5Z5U | - | 96U | C12 H10 N4 O2 | c1cn(cn1)c.... |
93 | 5TI4 | ic50 = 26 uM | 7CM | C16 H14 Cl F N2 O3 S | c1cc(cc(c1.... |
94 | 5Y8C | ic50 = 0.16 uM | 8P9 | C16 H15 Cl N2 O5 S | Cc1c2cc(c(.... |
95 | 4NUD | Ki < 0.0845 uM | NUD | C18 H17 N5 O3 S | Cc1cc(c(cc.... |
96 | 4O7B | ic50 = 20 uM | 2RJ | C26 H26 F N5 O | Cc1cccc(c1.... |
97 | 5CPE | ic50 = 0.45 uM | EB2 | C20 H24 N2 O3 S | CCN1c2ccc(.... |
98 | 5MLI | ic50 = 130 uM | 82I | C6 H8 Cl N3 O | CNC1=C(C(=.... |
99 | 5DW2 | Kd = 1.44 uM | 5GD | C24 H29 N3 O4 | Cc1cc(cc(c.... |
100 | 5D3P | Kd = 7.4 uM | 57E | C19 H21 N3 O4 S | CCc1c(c([n.... |
101 | 4PCE | ic50 = 7 uM | 2N0 | C17 H19 N O | CCc1cc2c(n.... |
102 | 5D25 | Kd = 0.46 uM | 56M | C19 H25 N3 O5 S | CCN(CC)S(=.... |
103 | 5DLZ | Kd = 1.8 uM | 5D1 | C28 H35 N3 O3 | Cc1cccc(c1.... |
104 | 5Y8W | ic50 = 0.23 uM | 8PU | C15 H13 Br N2 O5 S | Cc1c2cc(c(.... |
105 | 4J0R | ic50 = 0.386 uM | 1H2 | C18 H17 N O3 | Cc1c(c(on1.... |
106 | 6MH7 | ic50 = 1.3 uM | JQY | C26 H27 F N6 | Cc1ccc(cc1.... |
107 | 5F60 | Kd = 43 nM | 5VZ | C26 H34 Cl N7 O2 S | Cc1cnc(nc1.... |
108 | 5Z5V | ic50 = 287 nM | 96X | C15 H14 N4 O2 | CC(=O)Nc1c.... |
109 | 4HXO | - | 1A6 | C11 H10 N4 O S | Cc1cc(on1).... |
110 | 5CRM | ic50 = 1.09 uM | EB5 | C15 H16 N2 O3 S | CCNS(=O)(=.... |
111 | 6YQN | ic50 = 0.72 uM | P8T | C32 H28 Cl N7 O2 S | Cc1c(sc-2c.... |
112 | 5CQT | Kd = 0.124 uM | EB3 | C19 H22 N2 O3 S | CCN1c2ccc(.... |
113 | 5KHM | Ki = 5.012 nM | XNH | C25 H33 N7 O3 | C[C@@H]1C(.... |
114 | 6XV3 | - | O2B | C28 H33 N9 O | Cc1nnc2n1c.... |
115 | 4Z1S | ic50 = 0.79 uM | 559 | C23 H21 Cl N6 | Cc1nnc2n1-.... |
116 | 4MR3 | - | 1K0 | C20 H22 N2 O5 | Cc1cc(cc(c.... |
117 | 5MKZ | ic50 = 20 uM | RNK | C11 H12 Cl N3 O S | Cc1ccsc1CN.... |
118 | 5ULA | Ki = 77 nM | 5MJ | C20 H19 Cl N2 O3 | CC1=C(CCC1.... |
119 | 4O78 | ic50 = 4.6 uM | SAV | C21 H22 N6 O3 | Cc1c2ccc(c.... |
120 | 6XVC | - | O32 | C22 H21 N5 O2 | Cc1nnc2n1c.... |
121 | 4OGJ | Kd = 164 nM | 2TA | C27 H36 N6 O3 S | Cc1cnc(nc1.... |
122 | 5A85 | ic50 = 5.01 uM | 78J | C21 H30 N4 O2 | CC1=Cc2ccn.... |
123 | 5TI6 | ic50 = 21 uM | 7CO | C16 H14 F2 N2 O3 S | c1cc(cc(c1.... |
124 | 6MAU | - | JBS | C30 H32 N6 O3 | Cc1c(c(on1.... |
125 | 6S4B | Kd = 0.14 uM | KUH | C22 H29 N3 O5 S | CCN(CC)S(=.... |
126 | 6Q3Z | Kd = 44 nM | HG8 | C29 H38 N6 O2 S | CC[C@@H]1C.... |
127 | 6V0U | Kd = 392 nM | BMF | C17 H20 N6 O4 S | CCOC(=O)Nc.... |
128 | 6VUC | ic50 = 144 uM | RLS | C16 H22 N2 O3 S | CN1C[C@H](.... |
129 | 4MR4 | - | 1K0 | C20 H22 N2 O5 | Cc1cc(cc(c.... |
130 | 4QR5 | ic50 = 0.06 uM | BNM | C18 H21 N3 O4 S2 | c1c(cc(cc1.... |
131 | 4MEQ | - | 25O | C12 H11 N5 | Cc1cc(n2c(.... |
132 | 4O77 | ic50 = 2.5 uM | 2RE | C20 H14 F N3 O | c1cc(ccc1c.... |
133 | 6XUZ | - | O1W | C24 H33 N9 O2 | Cc1nnc2n1c.... |
134 | 5EI4 | ic50 = 26.4 uM | 5NV | C17 H17 Cl N8 O2 S | CCn1c(nc2c.... |
135 | 5CY9 | Kd = 0.218 uM | E0A | C17 H20 N2 O3 S | CCCCS(=O)(.... |
136 | 6MH1 | ic50 = 1.7 uM | JQP | C26 H27 F N6 | Cc1cc(cc(c.... |
137 | 5CRZ | ic50 = 0.45 uM | EB7 | C19 H14 Cl F N2 O3 S | CCN1c2ccc(.... |
138 | 5Y93 | ic50 = 2.27 uM | 8Q9 | C23 H27 Br N4 O7 S | Cc1c2cc(c(.... |
139 | 5AD2 | Kd = 63 nM | ETU | C24 H30 Cl N7 O2 | C[C@@H]1C(.... |
140 | 4E96 | ic50 = 0.22 uM | 0NS | C16 H17 N3 O4 S | CN1Cc2cc(c.... |
141 | 5D0C | Kd = 2.34 uM | E0B | C21 H25 N3 O4 S | CCN1c2ccc(.... |
142 | 4O7F | ic50 = 13 uM | 2RQ | C25 H24 F N5 O2 | COc1ccccc1.... |
143 | 5CP5 | Kd = 1.234 uM | EB0 | C19 H15 F N2 O3 S | CCN1c2ccc(.... |
144 | 4CFK | Kd = 1.83 uM | LY2 | C19 H17 N O3 | c1ccc(cc1).... |
145 | 5D3R | - | 57C | C23 H31 N3 O4 S | CCCc1c(c([.... |
146 | 4NUC | Ki = 0.91 uM | 435 | C19 H18 N4 O3 S | Cc1cc(cc(c.... |
147 | 4HXL | ic50 = 2.2 uM | 1A9 | C22 H25 N3 O4 S3 | c1cc(sc1)S.... |
148 | 6CIY | ic50 = 0.41 uM | F3J | C34 H42 N8 O3 | CN1CCN(CC1.... |
149 | 5D3L | Kd = 0.88 uM | 57F | C21 H29 N3 O5 S | CCc1c(c([n.... |
150 | 4A9L | - | P9L | C14 H19 N3 O4 S | CN1Cc2cc(c.... |
151 | 4XYA | Kd = 1370 nM | 43S | C13 H8 Br N5 O | c1coc2c1cc.... |
152 | 4C66 | - | H4C | C17 H16 Cl N4 S | CCc1cc2c(s.... |
153 | 6UWU | ic50 ~ 70 nM | QKP | C27 H34 N2 O6 | Cc1cc(cc(c.... |
154 | 4O76 | ic50 = 0.13 uM | 1M3 | C26 H35 N7 O2 S | Cc1cnc(nc1.... |
155 | 5LJ2 | ic50 = 10 uM | 6XW | C25 H32 N6 O4 S | CC1=Cc2c(c.... |
156 | 6CD5 | - | R4L | C35 H44 N8 O3 | CN1CCN(CC1.... |
157 | 5I80 | Kd = 62 nM | 67B | C17 H17 N3 O2 | CN1C=C(c2c.... |
158 | 4O75 | ic50 = 21 uM | 2RC | C23 H26 F N6 O9 P | CC1(C(=O)N.... |
159 | 5NNF | - | PHE LEU PRO HIS ALY TYR ASP VAL LYS LEU | n/a | n/a |
160 | 3ZYU | ic50 = 0.1 uM | 1GH | C23 H21 N5 O3 | Cc1c(c(on1.... |
161 | 4Z1Q | ic50 = 0.015 uM | 558 | C23 H21 Cl N6 | Cc1nnc2n1-.... |
162 | 6SA3 | Kd = 0.42 uM | L2N | C23 H30 N4 O5 S | Cc1c2c(c([.... |
163 | 5IGK | Kd = 41.8 nM | BMF | C17 H20 N6 O4 S | CCOC(=O)Nc.... |
164 | 5Y1Y | ic50 = 0.98 uM | HNQ | C9 H6 N2 O3 | c1cc2c(ccc.... |
165 | 5Z5T | - | 96R | C12 H10 N4 O | c1cc2c(cc(.... |
166 | 6V1U | - | QMG | C20 H19 N3 O2 | Cc1ccc(cc1.... |
167 | 5KDH | Ki = 0.37 uM | 6RX | C18 H17 N3 O4 | CCN1C2=C([.... |
168 | 4PS5 | ic50 = 0.29 uM | 2TA | C27 H36 N6 O3 S | Cc1cnc(nc1.... |
169 | 5D24 | Kd = 5.8 uM | L26 | C18 H21 N3 O4 | CCc1c(c([n.... |
170 | 5ACY | Kd = 6.4 nM | 9S3 | C30 H35 N3 O | C[C@H]1C[C.... |
171 | 5HCL | ic50 = 6 mM | 5Y9 | C4 H9 N O | CC(=O)N(C).... |
172 | 5COI | ic50 = 2.58 uM | 55K | C20 H22 N2 O5 S | CCN1c2ccc(.... |
173 | 6UWX | Kd = 290 uM | QKD | C12 H17 N O2 S2 | CCOC(=O)N1.... |
174 | 5Y8Y | Kd = 82 nM | 8PX | C16 H15 Br N2 O5 S | Cc1c2cc(c(.... |
175 | 4HXM | ic50 = 0.79 uM | 1A8 | C17 H17 N3 O4 S3 | CCCC(=O)Nc.... |
176 | 5F62 | Kd = 6.8 nM | 5W1 | C26 H33 Cl F N7 O2 S | Cc1cnc(nc1.... |
177 | 5D3S | Kd = 1.3 uM | 579 | C20 H24 F N3 O5 S | CCc1c(c([n.... |
178 | 6YQP | ic50 = 1.35 uM | P8N | C29 H27 Cl N6 O3 S | Cc1c(sc-2c.... |
179 | 6AJX | Kd = 9.1 uM | HCC | C15 H12 O4 | c1cc(ccc1C.... |
180 | 4LYW | Kd = 237 nM | 21Q | C20 H27 N3 O5 S | CCc1c(c([n.... |
181 | 4HBV | ic50 = 23 uM | 15E | C9 H9 Br N2 O | CN1Cc2cc(c.... |
182 | 5LUU | Kd = 8.63 uM | 77X | C15 H17 N3 O | CCC(=O)N1C.... |
183 | 4YH3 | ic50 = 26 uM | Y80 | C24 H20 N2 O3 | COc1ccc(cc.... |
184 | 6AJV | Kd = 9.1 uM | HCC | C15 H12 O4 | c1cc(ccc1C.... |
185 | 6CZV | ic50 = 0.23 uM | FOY | C17 H16 N2 O2 | Cc1c(c(on1.... |
186 | 4X2I | ic50 = 0.35 uM | 3X0 | C18 H17 Cl N4 | Cc1nnc2n1-.... |
187 | 6CJ1 | ic50 = 6.31 uM | FND | C34 H44 N8 O3 | CC[C@H](C).... |
188 | 5F5Z | Kd = 86 nM | 5VY | C26 H35 N7 O2 S | Cc1cnc(nc1.... |
189 | 6UVJ | Kd = 20 uM | QJ1 | C11 H15 N O2 S2 | COC(=O)N1C.... |
190 | 6FNX | ic50 = 12.6 uM | DYZ | C14 H14 N4 O2 | CCn1cnc2c1.... |
191 | 4HBY | ic50 = 4.4 uM | 13F | C15 H15 N3 O3 S | CN1Cc2cc(c.... |
192 | 5D3J | Kd = 5.7 uM | L33 | C20 H27 N3 O4 S | CCc1c(c([n.... |
193 | 6AJY | Kd = 5.3 uM | A0R | C16 H14 O4 | COc1ccccc1.... |
194 | 3MUL | - | GLY GLY BTK ALA PRO ARG LYS GLN | n/a | n/a |
195 | 4LR6 | ic50 = 33 uM | 1XA | C10 H10 N2 O | Cc1c(c(on1.... |
196 | 5AD3 | Kd = 7.9 nM | K6K | C26 H30 N10 O3 | CN(CCOc1cc.... |
197 | 4PCI | ic50 = 7.5 uM | 2NJ | C16 H16 N2 O | CN1c2ccccc.... |
198 | 5D3T | Kd = 12 uM | 56Y | C19 H23 N3 O3 | CCc1c(c([n.... |
199 | 6SAH | Kd = 0.26 uM | L2W | C23 H29 N3 O5 S | Cc1c2c(c([.... |
200 | 5LJ1 | ic50 > 0.0000316 M | 6XX | C28 H35 F2 N5 O3 | Cc1cc(cnc1.... |
201 | 4O70 | ic50 = 19 uM | 1QK | C21 H29 N6 O2 | CCc1cnn2c1.... |
202 | 4XY9 | Kd = 4651 nM | 43U | C12 H10 Br N5 O | COc1ccc(cc.... |
203 | 3MXF | - | JQ1 | C23 H26 Cl N4 O2 S | Cc1c(sc-2c.... |
204 | 5CFW | Kd = 0.78 uM | 53W | C27 H32 N4 O3 | Cc1c(c(on1.... |
205 | 5A5S | ic50 = 1.3 uM | NP8 | C20 H23 N5 O2 | CC1=Cc2c(c.... |
206 | 4UIY | ic50 = 0.00000001 M | 5V2 | C21 H20 F3 N3 O3 S2 | CN1C=C(c2c.... |
207 | 6PS9 | ic50 = 79 uM | Y17 | C18 H21 N3 O2 | CN1C[C@@H].... |
208 | 4LZR | Kd = 20 uM | LOC | C22 H25 N O6 | CC(=O)N[C@.... |
209 | 6PRT | ic50 = 2120 uM | OWA | C8 H13 N O3 | CN1C[C@H](.... |
210 | 4BW1 | ic50 = 1.26 uM | S5B | C25 H25 N3 O3 | Cc1c(c(on1.... |
211 | 6YQO | ic50 = 4.53 uM | P8Q | C33 H36 Cl N7 O4 S | Cc1c(sc-2c.... |
212 | 4MEN | - | 25K | C15 H17 N5 | Cc1ccc(cc1.... |
213 | 6CIS | ic50 = 0.3 uM | X26 | C37 H48 N8 O3 | CC(C)Oc1cc.... |
214 | 6CKR | ic50 = 0.05 uM | F5V | C21 H20 N4 O3 S | Cn1cc(cn1).... |
215 | 4UIZ | ic50 = 0.00001995 M | N1D | C22 H25 N3 O6 S2 | CN1C=C(c2c.... |
216 | 5KJ0 | ic50 = 130 nM | 6TB | C29 H41 N7 O3 | CC[C@@H]1C.... |
217 | 4KV1 | - | THR PHE ALY SER ILE MET LYS | n/a | n/a |
218 | 5EGU | Kd = 1.4 uM | 5NQ | C23 H32 N8 O2 S | CCCCc1c(nc.... |
219 | 5Y8Z | ic50 = 0.62 uM | 8Q3 | C16 H15 Br N2 O4 S | Cc1cc2c(cc.... |
220 | 6VUB | ic50 = 629 uM | RLG | C11 H13 N O | CN1C[C@H](.... |
221 | 4BW3 | ic50 = 501 nM | 9BM | C25 H26 N4 O4 | Cc1c(c(on1.... |
222 | 3U5K | - | 08J | C18 H13 Cl F N3 | Cc1ncc2n1-.... |
223 | 6FGH | - | 6RZ | C10 H16 N2 O2 S | Cc1c(cccn1.... |
224 | 6FG6 | - | D8Q | C9 H13 N3 O2 | CN1C=C(C=C.... |
225 | 6FGG | Kd = 17 uM | D9B | C18 H20 N4 O4 | CN1C=C(C=C.... |
226 | 5MGJ | Kd = 51 uM | 7MX | C9 H10 Cl N O3 | CCOC(=O)C1.... |
227 | 6FGV | - | D9T | C14 H21 N3 O2 | CN1C=C(C=C.... |
228 | 6FGL | ic50 = 24 uM | UO1 | C19 H18 N2 O3 | Cc1ccc(cc1.... |
229 | 5OR8 | - | JR4 | C17 H18 F N3 O3 S | Cc1cc2c(cc.... |
230 | 5FE0 | - | ALY | C8 H16 N2 O3 | CC(=O)NCCC.... |
231 | 5LVR | Kd = 250 uM | 78Y | C10 H10 N4 O | Cc1c(nn(n1.... |
232 | 5FDZ | Kd = 6.8 uM | 5X0 | C21 H24 N2 O5 | CNC(=O)c1c.... |
233 | 5FE1 | - | 12Q | C10 H9 N O | CN1c2ccccc.... |
234 | 5FE6 | Kd = 6910 uM | 5WZ | C9 H16 N2 O | C1CC1C(=O).... |
235 | 5FE2 | - | 5WV | C9 H9 N O | CN1Cc2cccc.... |
236 | 5FE7 | Kd = 488 uM | 5WU | C10 H14 N2 O2 | Cc1c2c(n(n.... |
237 | 5FE8 | - | 5WT | C13 H14 N2 O2 | CC1=CC(=O).... |
238 | 5FE4 | - | 5WY | C9 H9 N O3 | c1cc(c2c(c.... |
239 | 5FE9 | Kd = 20.98 uM | 5WS | C12 H14 N2 O3 S | CC1=CC(=O).... |
240 | 5FE5 | - | 2QC | C9 H9 N3 S | c1cc(ccc1C.... |
241 | 5MKX | ic50 = 20 uM | 82I | C6 H8 Cl N3 O | CNC1=C(C(=.... |
242 | 5LVQ | Kd = 73 uM | 2LX | C13 H17 N O3 | CNC(=O)c1c.... |
243 | 5FE3 | - | 5WX | C8 H8 N2 O2 | COc1cccc2c.... |
244 | 6C7Q | - | EO1 | C25 H23 N7 O2 | Cc1c(c(on1.... |
245 | 2YEM | ic50 = 15.5 nM | WSH | C25 H21 N5 O2 | Cc1nnc2n1-.... |
246 | 5JWM | ic50 = 3.09 nM | 6ON | C54 H66 Cl2 N10 O9 S2 | Cc1c(sc-2c.... |
247 | 5UOO | Ki = 1.4 nM | 8FV | C26 H21 N5 O2 | Cc1c(c(on1.... |
248 | 3QZS | Kd = 99 uM | LYS GLY GLY ALA ALY ARG HIS ARG LYS VAL | n/a | n/a |
249 | 3QZT | - | LYS GLY GLY ALA ALY ARG HIS ARG LYS VAL | n/a | n/a |
250 | 5U6V | ic50 = 21 nM | 7WY | C22 H19 Cl N6 | Cc1c-2n(nn.... |
251 | 5O3A | - | 31P | C23 H23 Cl N4 O3 | CC[C@H]([C.... |
252 | 5DFD | - | 59E | C23 H21 N5 O3 | Cc1nnc2n1-.... |
253 | 5XHK | - | LDR | C13 H9 N O | c1ccc2c(c1.... |
254 | 5O3D | - | 9J5 | C23 H23 Cl N4 O3 | CC[C@H]([C.... |
255 | 6YTM | Kd = 65 nM | PMW | C22 H25 Cl N4 O2 S | CC[C@H]([C.... |
256 | 6VIY | Ki = 1.1 nM | QYY | C27 H29 N3 O5 S | CCNC(=O)c1.... |
257 | 5IG6 | Kd = 213.7 uM | 6B3 | C27 H18 N2 O4 | c1ccc2c(c1.... |
258 | 5O3G | - | 9J8 | C25 H26 Cl N5 O2 | CCNC(=O)[C.... |
259 | 4J1P | Kd = 0.206 uM | 1K0 | C20 H22 N2 O5 | Cc1cc(cc(c.... |
260 | 5O3I | - | 9HN | C27 H29 Cl N4 O3 | Cc1nnc2n1-.... |
261 | 5UEW | - | 87D | C20 H20 N2 O5 S | CN1C=C(C(=.... |
262 | 5O3B | - | 9HZ | C24 H23 Cl N4 O3 | Cc1nnc2n1-.... |
263 | 5O3E | - | 9HW | C23 H24 Cl N5 O2 | CCNC(=O)[C.... |
264 | 3ONI | - | JQ1 | C23 H26 Cl N4 O2 S | Cc1c(sc-2c.... |
265 | 6K04 | Ki = 3.1 nM | CQF | C22 H21 Cl N6 | Cc1nnc2n1-.... |
266 | 5O39 | - | 31O | C22 H21 Cl N4 O3 | Cc1nnc2n1-.... |
267 | 5O3H | - | 9HQ | C23 H24 Cl N5 O2 | CCNC(=O)[C.... |
268 | 5O3C | - | 9J2 | C22 H21 Cl N4 O3 | Cc1nnc2n1-.... |
269 | 4MR6 | - | 1K0 | C20 H22 N2 O5 | Cc1cc(cc(c.... |
270 | 6MOA | Kd = 2.5 nM | JW4 | C25 H22 N4 O | Cc1ccc2c(c.... |
271 | 5DW1 | ic50 = 0.08 uM | 5GD | C24 H29 N3 O4 | Cc1cc(cc(c.... |
272 | 5DFC | - | EAM | C22 H22 Cl N5 O2 | CCNC(=O)C[.... |
273 | 4MR5 | - | 1K0 | C20 H22 N2 O5 | Cc1cc(cc(c.... |
274 | 5O3F | - | 9HT | C24 H26 Cl N5 O2 | CC[C@H]([C.... |
275 | 2WP1 | - | LYS ALA PRO ARG ALY GLN LEU ALA THR LYS | n/a | n/a |
276 | 4FLP | Kd = 190.1 nM | JQ1 | C23 H26 Cl N4 O2 S | Cc1c(sc-2c.... |
277 | 4KCX | Kd = 37 uM | 1QK | C21 H29 N6 O2 | CCc1cnn2c1.... |
278 | 4A9I | - | P9I | C15 H13 N2 O | C/C(=C/1C=.... |
279 | 4UYH | ic50 = 0.00000001 M | 9S3 | C30 H35 N3 O | C[C@H]1C[C.... |
280 | 4A9H | - | TVP | C12 H15 N O | C[C@H]1CCc.... |
281 | 4A9F | - | MB3 | C5 H9 N O | CN1CCCC1=O |
282 | 4ALG | ic50 = 0.5 uM | 1GH | C23 H21 N5 O3 | Cc1c(c(on1.... |
283 | 2YEK | ic50 = 32.5 nM | EAM | C22 H22 Cl N5 O2 | CCNC(=O)C[.... |
284 | 2YDW | Kd = 46 nM | WSH | C25 H21 N5 O2 | Cc1nnc2n1-.... |
285 | 4A9J | - | TYL | C8 H9 N O2 | CC(=O)Nc1c.... |
286 | 4A9M | ic50 = 0.5 uM | P9M | C17 H22 N2 O3 S | Cc1ccc(cc1.... |
287 | 4ALH | - | A9P | C11 H11 N O | Cc1c(c(on1.... |
288 | 4A9E | - | 3PF | C9 H10 N2 O | CN1Cc2cccc.... |
289 | 4A9O | - | A9O | C12 H13 N O | CCc1c(c(no.... |
290 | 4AKN | ic50 = 0.79 uM | S5B | C25 H25 N3 O3 | Cc1c(c(on1.... |
291 | 4A9N | ic50 = 1.5 uM | A9N | C15 H16 N2 O3 S | Cc1ccc(cc1.... |
292 | 4KV4 | - | THR PHE ALY SER ILE MET LYS | n/a | n/a |
293 | 5UEZ | Ki = 970 nM | 89G | C18 H16 N2 O3 | CN1C(=O)C=.... |
294 | 6VIX | Ki = 1.3 nM | QYV | C24 H21 F2 N3 O5 S | CCNC(=O)c1.... |
295 | 5UF0 | Ki = 160 uM | 89J | C12 H13 N3 O | CNC1=CC(=O.... |
296 | 5UEU | - | 0S6 | C20 H19 Cl N4 O2 S | Cc1c(sc-2c.... |
297 | 4Z93 | Kd = 44.6 nM | 4LD | C24 H23 N5 O2 | Cc1c(c(n[n.... |
298 | 5UEY | Ki = 5.1 nM | 88M | C22 H24 F2 N2 O5 S | CCOC1=CC(=.... |
299 | 5UEX | Ki = 1.5 nM | 89D | C24 H26 F2 N2 O5 S | CCS(Nc1ccc.... |
300 | 5I8B | ic50 = 0.11 uM | 69F | C23 H22 N2 O2 | C[C@@H]1CC.... |
301 | 5I8G | Kd = 0.03 uM | 69E | C22 H22 N6 O | C[C@@H]1CC.... |
302 | 5N18 | Kd = 2.1 uM | 8HZ | C21 H19 N3 O | Cc1ccc(cc1.... |
303 | 5MLJ | Ki = 1.4 nM | 9ST | C17 H21 Br N4 O | CN1C[C@H](.... |
304 | 6J3P | Kd = 105 nM | B8O | C21 H25 N5 O3 | CN1C[C@H](.... |
305 | 6AXQ | ic50 = 99000 nM | C2Y | C10 H9 N O2 | COC(=O)c1c.... |
306 | 5DBM | Kd = 0.35 uM | 58N | C17 H22 N4 O | C[C@@H]1CC.... |
307 | 5LPM | Kd = 2.77 uM | 71Y | C20 H23 Cl N2 O3 | CCc1c(c([n.... |
308 | 5NRW | - | 96N | C21 H22 N2 O2 | CCc1c(c([n.... |
309 | 3P1D | - | MB3 | C5 H9 N O | CN1CCCC1=O |
310 | 5LPJ | Kd = 10.1 uM | XDM | C17 H19 Cl N2 O2 | CCc1c(c([n.... |
311 | 6FQO | ic50 = 0.14 uM | E2T | C26 H24 N2 O6 | CCOc1ccc(c.... |
312 | 4TQN | Kd = 0.77 uM | UL4 | C18 H17 N O5 | CCOc1ccc(c.... |
313 | 6FRF | ic50 = 0.04 uM | E3T | C26 H24 N2 O5 | CCOc1ccc(c.... |
314 | 5TB6 | Kd = 1.53 uM | 77X | C15 H17 N3 O | CCC(=O)N1C.... |
315 | 5MQK | - | QPR | C11 H11 N O | CC(=O)c1cn.... |
316 | 5MQG | - | F31 | C9 H11 N O2 | CC(=O)c1cc.... |
317 | 5I83 | ic50 = 4.1 uM | 68Y | C18 H20 N2 O2 | C[C@@H]1CC.... |
318 | 4A9K | - | TYL | C8 H9 N O2 | CC(=O)Nc1c.... |
319 | 5I86 | ic50 = 0.53 uM | 69A | C18 H19 N3 O2 | C[C@@H]1CC.... |
320 | 6FR0 | ic50 = 0.146 uM | E3H | C27 H26 N2 O6 | CCN1C(=O)C.... |
321 | 5NU5 | Kd = 0.47 uM | 99E | C21 H22 N2 O4 | CCc1c(c([n.... |
322 | 5LPK | Kd = 3.06 uM | XDM | C17 H19 Cl N2 O2 | CCc1c(c([n.... |
323 | 5MME | Kd = 1.4 uM | 8Q6 | C20 H21 N O6 | CCOc1ccc(c.... |
324 | 5I89 | ic50 = 0.033 uM | 69B | C21 H22 N4 O | C[C@@H]1CC.... |
325 | 5NU3 | Kd = 0.23 uM | 99E | C21 H22 N2 O4 | CCc1c(c([n.... |
326 | 5OWK | - | 7MX | C9 H10 Cl N O3 | CCOC(=O)C1.... |
327 | 6AY5 | ic50 = 69 nM | C3V | C22 H20 F2 N4 O S | Cn1cc(cn1).... |
328 | 5LPL | Kd = 12 uM | 71X | C20 H23 Cl N2 O3 | CCc1c(c([n.... |
329 | 6FQU | ic50 = 2.2 uM | E3B | C21 H23 F2 N O2 | CCOc1ccc(c.... |
330 | 6DMK | - | 2LL | C26 H30 N4 O2 | Cc1c(c(on1.... |
331 | 5MMG | Kd = 0.97 uM | UT0 | C19 H20 N2 O4 S | CCOc1ccc(c.... |
332 | 5MPN | Kd = 0.085 uM | YE5 | C17 H16 N4 O2 | CCOc1ccc(c.... |
333 | 5J0D | Kd = 134 nM | 6F9 | C27 H35 N3 O5 | CCC(=O)N1C.... |
334 | 6AY3 | ic50 = 9.5 nM | C3J | C24 H23 F2 N5 O | CNC(=O)c1c.... |
335 | 5MPK | Kd = 0.003 uM | 0BC | C21 H18 N6 O3 S | CCOc1ccc(c.... |
336 | 5CGP | Kd = 0.12 uM | 53W | C27 H32 N4 O3 | Cc1c(c(on1.... |
337 | 4BJX | ic50 = 22 nM | 73B | C25 H23 Cl N2 O3 | C[C@H]1C[C.... |
338 | 4UYD | ic50 = 79.4 uM | V1T | C10 H11 N3 O2 | CN1c2ccc(c.... |
339 | 4XUB | ic50 = 1.07 uM | 43D | C19 H18 N8 | Cc1cn(nn1).... |
340 | 4XUA | ic50 = 26 uM | 43C | C21 H18 N6 | Cc1cn(nn1).... |
341 | 5MGF | Kd = 54 uM | 7MW | C9 H11 N O3 | CCC(=O)c1c.... |
342 | 5E9I | - | F60 | C8 H7 N O | c1cc(cc2c1.... |
343 | 6FGT | - | D9T | C14 H21 N3 O2 | CN1C=C(C=C.... |
344 | 4NRB | ic50 = 38 uM | 2LX | C13 H17 N O3 | CNC(=O)c1c.... |
345 | 6FH6 | - | D8Q | C9 H13 N3 O2 | CN1C=C(C=C.... |
346 | 5MGG | - | 7MU | C7 H7 Cl N2 O | CNC(=O)c1c.... |
347 | 5ORB | - | JR6 | C16 H19 N3 O2 S | Cn1c(c2c(n.... |
348 | 4NRC | ic50 = 241 uM | 2LY | C8 H9 N O3 S | CNC(=O)c1c.... |
349 | 6FH7 | - | EN2 | C17 H18 F N3 O3 | CN1C=C(C=C.... |
350 | 5E9K | - | 5KX | C3 H3 Cl N2 | c1cnc([nH].... |
351 | 4NRA | Kd = 65 uM | 2LW | C13 H13 Cl N2 O | CC(=O)N1CC.... |
352 | 5MGE | Kd = 87 uM | 7MX | C9 H10 Cl N O3 | CCOC(=O)C1.... |
353 | 4NR9 | - | ALY | C8 H16 N2 O3 | CC(=O)NCCC.... |
354 | 5E9L | - | 6AI | C7 H7 N3 | c1cc2cn[nH.... |
355 | 5OR9 | ic50 = 88 uM | JR5 | C18 H21 F N4 O3 S | Cn1c(c2c(n.... |
356 | 5E74 | Kd = 39 uM | 5KH | C25 H19 F3 N2 O3 | Cc1ccc(cc1.... |
357 | 5E9M | - | BAE | C6 H13 N O | CC(C)(C)C(.... |
358 | 6FGU | - | D9Q | C13 H19 N3 O2 | CN1C=C(C=C.... |
359 | 5DYX | - | ADE | C5 H5 N5 | c1[nH]c2c(.... |
360 | 5DYU | - | MZ0 | C4 H6 N2 O | c1c([nH]cn.... |
361 | 5E73 | Kd = 23 uM | UO1 | C19 H18 N2 O3 | Cc1ccc(cc1.... |
362 | 7K6R | - | 9ST | C17 H21 Br N4 O | CN1C[C@H](.... |
363 | 7KDW | - | WCV | C20 H21 N5 O | C#CCNc1ncc.... |
364 | 7KDZ | - | WCS | C22 H30 N6 O3 S | CN(C)CCCOc.... |
365 | 7K6S | - | VYM | C13 H16 N2 O | c1cc2c(cc1.... |
366 | 5A7C | ic50 = 0.00018 M | 5D4 | C10 H20 N2 O2 | CC(=O)NCCC.... |
367 | 5TPX | Kd = 280 nM | 7H7 | C21 H24 N6 | Cc1nnc2n1n.... |
368 | 6MO8 | - | JWD | C19 H17 N3 O2 | Cc1c(c(on1.... |
369 | 6ONY | - | HWV | C28 H30 F N3 O4 | CCNC(=O)c1.... |
370 | 6JKE | - | BUX | C13 H6 Cl2 N2 O4 | c1cc(cc(c1.... |
371 | 6MO7 | - | JWA | C19 H25 N3 O4 S | Cc1ccc(cc1.... |
372 | 6MO9 | - | JVY | C19 H21 N3 O3 S | Cc1c(c(on1.... |
373 | 3AQA | - | BYH | C17 H16 N4 S2 | CN1c2ccccc.... |
374 | 6K05 | Ki = 95.5 nM | CQF | C22 H21 Cl N6 | Cc1nnc2n1-.... |
375 | 5WUU | ic50 = 0.81 uM | 7UU | C18 H18 N2 O3 S | CN(CCCNC1=.... |
376 | 5N17 | Kd = 4.8 uM | 8FK | C19 H18 N2 O3 S | CN1c2ccc(c.... |
377 | 5N16 | Kd = 5 uM | 8FN | C22 H15 N5 O2 S | c1ccc2c(c1.... |
378 | 6VIZ | Ki = 120 nM | QYY | C27 H29 N3 O5 S | CCNC(=O)c1.... |
379 | 6VIW | Ki = 21.6 nM | QYV | C24 H21 F2 N3 O5 S | CCNC(=O)c1.... |
380 | 5XXH | ic50 = 6.8 uM | E0D | C18 H20 N2 O4 | CC(=O)c1cn.... |
381 | 5ML0 | - | P2L | C11 H17 Cl N4 O | CN1CCC[C@H.... |
382 | 5W0L | ic50 = 1.1 nM | 9UD | C27 H32 F2 N6 O2 | CC(=O)N1CC.... |
383 | 5W0F | ic50 = 16 nM | 9U7 | C25 H30 N6 O2 | CC(=O)N1CC.... |
384 | 5W0E | ic50 = 0.94 nM | 9U4 | C27 H33 F2 N7 O2 | CNC(=O)N1C.... |
385 | 5W0Q | ic50 = 18 uM | 9UG | C12 H16 N2 O2 | Cc1ccc2c(c.... |
386 | 5W0I | ic50 = 1.4 nM | 9UA | C26 H30 F2 N6 O2 | CC(=O)N1CC.... |
387 | 5VOM | ic50 = 0.79 uM | 9GY | C24 H23 N3 O4 | C[C@H]1CN(.... |
388 | 2RI7 | - | ALA ARG THR MLY GLN THR ALA ARG LYS | n/a | n/a |
389 | 6J3O | Kd = 2.4 uM | B4L | C13 H19 N5 O | CN1CCC[C@H.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 7MX | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | AMR | 0.9720 |
2 | XDE | 0.9523 |
3 | ALE | 0.9523 |
4 | H4E | 0.9474 |
5 | 2FY | 0.9470 |
6 | 1A7 | 0.9467 |
7 | 6VD | 0.9452 |
8 | LNR | 0.9414 |
9 | D8Q | 0.9398 |
10 | M78 | 0.9385 |
11 | SRO | 0.9381 |
12 | MS9 | 0.9377 |
13 | N8Y | 0.9372 |
14 | 1QP | 0.9369 |
15 | A7H | 0.9356 |
16 | EGR | 0.9349 |
17 | 92P | 0.9346 |
18 | BK9 | 0.9340 |
19 | 4KL | 0.9335 |
20 | 535 | 0.9335 |
21 | C2Y | 0.9333 |
22 | 2LY | 0.9330 |
23 | HBO | 0.9319 |
24 | L99 | 0.9312 |
25 | 94W | 0.9309 |
26 | N2I | 0.9307 |
27 | 8W9 | 0.9304 |
28 | CKA | 0.9302 |
29 | TSR | 0.9299 |
30 | 28S | 0.9297 |
31 | UAN | 0.9296 |
32 | 4VS | 0.9296 |
33 | TSS | 0.9296 |
34 | 57O | 0.9295 |
35 | SBK | 0.9293 |
36 | KDV | 0.9291 |
37 | VXX | 0.9289 |
38 | 2AK | 0.9280 |
39 | F52 | 0.9267 |
40 | KYA | 0.9256 |
41 | KMY | 0.9251 |
42 | LDP | 0.9250 |
43 | N1E | 0.9245 |
44 | NFM | 0.9244 |
45 | 28N | 0.9242 |
46 | L22 | 0.9240 |
47 | M4E | 0.9236 |
48 | 3C4 | 0.9235 |
49 | JXK | 0.9229 |
50 | CFA | 0.9229 |
51 | 61M | 0.9228 |
52 | 0F9 | 0.9228 |
53 | 8HC | 0.9225 |
54 | IAC | 0.9225 |
55 | ONR | 0.9224 |
56 | OW7 | 0.9220 |
57 | I6G | 0.9220 |
58 | RD4 | 0.9218 |
59 | FWD | 0.9218 |
60 | JXW | 0.9215 |
61 | 0FK | 0.9214 |
62 | CK1 | 0.9210 |
63 | NAG | 0.9209 |
64 | J9T | 0.9207 |
65 | 2HQ | 0.9205 |
66 | 30G | 0.9204 |
67 | CWJ | 0.9203 |
68 | V1T | 0.9202 |
69 | 8XL | 0.9199 |
70 | 3QV | 0.9194 |
71 | FF2 | 0.9193 |
72 | B56 | 0.9192 |
73 | 89J | 0.9192 |
74 | SHA | 0.9189 |
75 | C9E | 0.9187 |
76 | DHY | 0.9182 |
77 | ZME | 0.9179 |
78 | ETV | 0.9179 |
79 | 5XC | 0.9179 |
80 | N91 | 0.9176 |
81 | E1T | 0.9167 |
82 | AJY | 0.9165 |
83 | F4E | 0.9165 |
84 | 7VS | 0.9165 |
85 | NVU | 0.9161 |
86 | 4I8 | 0.9159 |
87 | 5F5 | 0.9159 |
88 | GZQ | 0.9159 |
89 | CIY | 0.9157 |
90 | 3VX | 0.9151 |
91 | ODO | 0.9151 |
92 | 42J | 0.9151 |
93 | E7Z | 0.9149 |
94 | 9R5 | 0.9145 |
95 | MUA | 0.9144 |
96 | 4Z4 | 0.9142 |
97 | S0G | 0.9139 |
98 | BQ2 | 0.9138 |
99 | 36M | 0.9136 |
100 | PEY | 0.9136 |
101 | 4V2 | 0.9135 |
102 | TT4 | 0.9133 |
103 | MQB | 0.9131 |
104 | JYW | 0.9130 |
105 | DNF | 0.9130 |
106 | JYT | 0.9129 |
107 | JYK | 0.9129 |
108 | IWT | 0.9129 |
109 | DHC | 0.9128 |
110 | EYJ | 0.9125 |
111 | 795 | 0.9120 |
112 | BWD | 0.9120 |
113 | N0Z | 0.9119 |
114 | 4TU | 0.9119 |
115 | PH2 | 0.9118 |
116 | PJW | 0.9117 |
117 | 9FE | 0.9117 |
118 | IV2 | 0.9116 |
119 | HA5 | 0.9115 |
120 | D3G | 0.9112 |
121 | M0W | 0.9109 |
122 | NPA | 0.9109 |
123 | AEH | 0.9108 |
124 | XEN | 0.9107 |
125 | 8GK | 0.9105 |
126 | GO8 | 0.9104 |
127 | M5H | 0.9103 |
128 | EYV | 0.9102 |
129 | ARP | 0.9100 |
130 | UFO | 0.9099 |
131 | IOP | 0.9098 |
132 | MD6 | 0.9097 |
133 | MPK | 0.9096 |
134 | QBM | 0.9094 |
135 | NLA | 0.9093 |
136 | BZ3 | 0.9092 |
137 | 7FF | 0.9091 |
138 | VM1 | 0.9091 |
139 | 6KT | 0.9091 |
140 | 67Y | 0.9090 |
141 | DRG | 0.9090 |
142 | HHR | 0.9089 |
143 | 9ZE | 0.9089 |
144 | DNC | 0.9089 |
145 | 9BF | 0.9087 |
146 | IWD | 0.9087 |
147 | M6Z | 0.9084 |
148 | BCU | 0.9084 |
149 | F9Y | 0.9084 |
150 | CWD | 0.9084 |
151 | 5V7 | 0.9082 |
152 | HDH | 0.9082 |
153 | L07 | 0.9081 |
154 | 15N | 0.9081 |
155 | J9Q | 0.9079 |
156 | IOS | 0.9079 |
157 | 3TC | 0.9078 |
158 | 3J8 | 0.9078 |
159 | 9UL | 0.9076 |
160 | 5TY | 0.9075 |
161 | 92G | 0.9074 |
162 | TCR | 0.9072 |
163 | ZYR | 0.9072 |
164 | S8D | 0.9067 |
165 | DK1 | 0.9064 |
166 | 2BG | 0.9064 |
167 | 5WU | 0.9063 |
168 | OTR | 0.9063 |
169 | 0LH | 0.9062 |
170 | 4AV | 0.9062 |
171 | OMD | 0.9061 |
172 | Z5P | 0.9060 |
173 | 0JD | 0.9059 |
174 | 1F1 | 0.9058 |
175 | CWS | 0.9058 |
176 | 8U3 | 0.9058 |
177 | 3R6 | 0.9056 |
178 | CH9 | 0.9056 |
179 | 7I2 | 0.9053 |
180 | R9Y | 0.9052 |
181 | 8WT | 0.9051 |
182 | N7I | 0.9050 |
183 | HQD | 0.9050 |
184 | 5OB | 0.9049 |
185 | 86J | 0.9049 |
186 | KJU | 0.9049 |
187 | BZJ | 0.9049 |
188 | JND | 0.9049 |
189 | H7Y | 0.9048 |
190 | H33 | 0.9045 |
191 | N2Z | 0.9045 |
192 | 8Y7 | 0.9044 |
193 | LEL | 0.9044 |
194 | 2O6 | 0.9044 |
195 | MSR | 0.9044 |
196 | 92K | 0.9043 |
197 | LDR | 0.9042 |
198 | 6HP | 0.9042 |
199 | 52C | 0.9042 |
200 | AA | 0.9040 |
201 | TQU | 0.9040 |
202 | BGC | 0.9040 |
203 | 6NT | 0.9039 |
204 | F31 | 0.9039 |
205 | JB8 | 0.9037 |
206 | CK2 | 0.9036 |
207 | 9AP | 0.9036 |
208 | HLZ | 0.9036 |
209 | TRP | 0.9036 |
210 | TXW | 0.9032 |
211 | 5GU | 0.9032 |
212 | JY2 | 0.9031 |
213 | 8NX | 0.9031 |
214 | THA | 0.9031 |
215 | GO2 | 0.9030 |
216 | 9FL | 0.9030 |
217 | MNP | 0.9030 |
218 | E35 | 0.9029 |
219 | M1H | 0.9028 |
220 | I3A | 0.9028 |
221 | 2SX | 0.9028 |
222 | KUF | 0.9027 |
223 | 0HO | 0.9027 |
224 | 15E | 0.9027 |
225 | MR1 | 0.9026 |
226 | OTW | 0.9024 |
227 | 209 | 0.9023 |
228 | 8TX | 0.9022 |
229 | C9M | 0.9021 |
230 | EV3 | 0.9021 |
231 | E1P | 0.9021 |
232 | FCD | 0.9020 |
233 | KTW | 0.9019 |
234 | ANF | 0.9019 |
235 | EOL | 0.9018 |
236 | 6BL | 0.9018 |
237 | 6NI | 0.9018 |
238 | CR1 | 0.9018 |
239 | 4ME | 0.9018 |
240 | CXH | 0.9017 |
241 | 8ZE | 0.9017 |
242 | 2JK | 0.9017 |
243 | AQO | 0.9016 |
244 | 54X | 0.9016 |
245 | B55 | 0.9015 |
246 | I2E | 0.9015 |
247 | XDK | 0.9015 |
248 | JDN | 0.9014 |
249 | 1IT | 0.9014 |
250 | 3A9 | 0.9013 |
251 | NID | 0.9012 |
252 | M0Q | 0.9011 |
253 | 069 | 0.9011 |
254 | 5VL | 0.9011 |
255 | 0HN | 0.9010 |
256 | X8D | 0.9009 |
257 | FER | 0.9009 |
258 | ASC | 0.9009 |
259 | QMS | 0.9008 |
260 | S7G | 0.9008 |
261 | 2HU | 0.9006 |
262 | OX2 | 0.9005 |
263 | NBV | 0.9003 |
264 | ABI | 0.9003 |
265 | BPY | 0.9003 |
266 | GF4 | 0.9003 |
267 | 4MU | 0.9002 |
268 | 2GQ | 0.9002 |
269 | L13 | 0.9002 |
270 | 2FQ | 0.9001 |
271 | JXT | 0.9000 |
272 | 2ZM | 0.9000 |
273 | AZ8 | 0.8999 |
274 | CKU | 0.8998 |
275 | W81 | 0.8998 |
276 | 6ZX | 0.8998 |
277 | 363 | 0.8995 |
278 | 6ME | 0.8995 |
279 | AC2 | 0.8994 |
280 | 42A | 0.8994 |
281 | MEW | 0.8994 |
282 | 55D | 0.8993 |
283 | 5NI | 0.8993 |
284 | 5JQ | 0.8993 |
285 | GCU | 0.8993 |
286 | KF5 | 0.8992 |
287 | RUG | 0.8991 |
288 | 3NY | 0.8991 |
289 | DQU | 0.8990 |
290 | QBK | 0.8990 |
291 | INO | 0.8990 |
292 | 7WR | 0.8990 |
293 | 39O | 0.8989 |
294 | APS | 0.8987 |
295 | AY4 | 0.8987 |
296 | XAZ | 0.8987 |
297 | 1WC | 0.8987 |
298 | K82 | 0.8986 |
299 | DEW | 0.8986 |
300 | PDC | 0.8986 |
301 | OA1 | 0.8984 |
302 | L46 | 0.8984 |
303 | 3MB | 0.8984 |
304 | JTA | 0.8983 |
305 | 7MW | 0.8983 |
306 | HHH | 0.8983 |
307 | JP2 | 0.8982 |
308 | XHP | 0.8981 |
309 | JRB | 0.8980 |
310 | 75K | 0.8979 |
311 | AZ9 | 0.8978 |
312 | GCS | 0.8978 |
313 | PD2 | 0.8977 |
314 | 9KZ | 0.8976 |
315 | 4YO | 0.8975 |
316 | BDP | 0.8975 |
317 | 0N7 | 0.8974 |
318 | 44W | 0.8973 |
319 | 226 | 0.8972 |
320 | 9CA | 0.8972 |
321 | 0TU | 0.8972 |
322 | URC | 0.8972 |
323 | APZ | 0.8972 |
324 | BB4 | 0.8972 |
325 | I59 | 0.8972 |
326 | 0GZ | 0.8971 |
327 | MVN | 0.8971 |
328 | S24 | 0.8971 |
329 | OVM | 0.8970 |
330 | M5K | 0.8970 |
331 | DHB | 0.8970 |
332 | H4B | 0.8970 |
333 | GC2 | 0.8970 |
334 | JWS | 0.8969 |
335 | LL1 | 0.8967 |
336 | DRL | 0.8967 |
337 | G6P | 0.8967 |
338 | 45L | 0.8966 |
339 | FLV | 0.8966 |
340 | GCB | 0.8966 |
341 | 6X9 | 0.8965 |
342 | KW8 | 0.8965 |
343 | B41 | 0.8964 |
344 | 5OF | 0.8964 |
345 | 5NS | 0.8964 |
346 | 1X8 | 0.8963 |
347 | PE0 | 0.8963 |
348 | THM | 0.8963 |
349 | MIL | 0.8963 |
350 | KWH | 0.8962 |
351 | 8G0 | 0.8961 |
352 | 0NX | 0.8961 |
353 | 7ZC | 0.8960 |
354 | 4HC | 0.8960 |
355 | 4Z3 | 0.8960 |
356 | 5QY | 0.8960 |
357 | C0W | 0.8959 |
358 | QPR | 0.8959 |
359 | DAH | 0.8959 |
360 | TAG | 0.8959 |
361 | MIG | 0.8958 |
362 | 4A3 | 0.8958 |
363 | FHB | 0.8957 |
364 | 4NC | 0.8957 |
365 | VNL | 0.8957 |
366 | SYE | 0.8957 |
367 | PQ0 | 0.8956 |
368 | 1P8 | 0.8956 |
369 | E7R | 0.8955 |
370 | 0XT | 0.8955 |
371 | HHS | 0.8955 |
372 | 9MG | 0.8955 |
373 | CLZ | 0.8954 |
374 | VK3 | 0.8953 |
375 | 68A | 0.8952 |
376 | AJV | 0.8952 |
377 | 7AP | 0.8951 |
378 | LZB | 0.8951 |
379 | CHB | 0.8951 |
380 | FC2 | 0.8950 |
381 | 3IL | 0.8950 |
382 | M5E | 0.8950 |
383 | EXD | 0.8950 |
384 | 6QF | 0.8949 |
385 | 5RN | 0.8949 |
386 | G3F | 0.8949 |
387 | MAJ | 0.8948 |
388 | SY4 | 0.8947 |
389 | 1P7 | 0.8946 |
390 | ICO | 0.8945 |
391 | CX4 | 0.8943 |
392 | 23J | 0.8941 |
393 | MCY | 0.8941 |
394 | EYY | 0.8940 |
395 | GNV | 0.8940 |
396 | AJ2 | 0.8940 |
397 | PRZ | 0.8940 |
398 | YE7 | 0.8939 |
399 | 5B1 | 0.8938 |
400 | A29 | 0.8937 |
401 | JA8 | 0.8937 |
402 | HWD | 0.8937 |
403 | NNO | 0.8936 |
404 | 93K | 0.8936 |
405 | EDR | 0.8936 |
406 | EWG | 0.8935 |
407 | L03 | 0.8935 |
408 | K37 | 0.8935 |
409 | IQ5 | 0.8934 |
410 | JLZ | 0.8934 |
411 | FA0 | 0.8934 |
412 | CPZ | 0.8934 |
413 | STX | 0.8933 |
414 | 2HO | 0.8933 |
415 | OW4 | 0.8932 |
416 | EA1 | 0.8932 |
417 | GOE | 0.8930 |
418 | DBJ | 0.8929 |
419 | BTY | 0.8929 |
420 | D2G | 0.8928 |
421 | 5OO | 0.8928 |
422 | BEA | 0.8928 |
423 | 1KP | 0.8928 |
424 | ES2 | 0.8927 |
425 | 97T | 0.8926 |
426 | 9TW | 0.8926 |
427 | KBB | 0.8926 |
428 | 2K8 | 0.8924 |
429 | GDE | 0.8923 |
430 | JF2 | 0.8922 |
431 | D07 | 0.8922 |
432 | ZZZ | 0.8922 |
433 | 49O | 0.8922 |
434 | MP5 | 0.8922 |
435 | 3EB | 0.8921 |
436 | FDR | 0.8921 |
437 | LTT | 0.8920 |
438 | 7VP | 0.8920 |
439 | XX2 | 0.8920 |
440 | HQ9 | 0.8920 |
441 | BOQ | 0.8919 |
442 | GTQ | 0.8919 |
443 | 96R | 0.8919 |
444 | 6J9 | 0.8919 |
445 | X48 | 0.8919 |
446 | PYU | 0.8919 |
447 | SAF | 0.8919 |
448 | BNL | 0.8919 |
449 | HPT | 0.8918 |
450 | B4O | 0.8918 |
451 | 790 | 0.8917 |
452 | JYB | 0.8917 |
453 | 7CT | 0.8917 |
454 | 8IG | 0.8916 |
455 | Q24 | 0.8914 |
456 | ESI | 0.8914 |
457 | 5WY | 0.8914 |
458 | VYM | 0.8914 |
459 | HA7 | 0.8914 |
460 | MFZ | 0.8913 |
461 | H5B | 0.8913 |
462 | I3E | 0.8913 |
463 | MYJ | 0.8913 |
464 | GZ2 | 0.8912 |
465 | 8NB | 0.8912 |
466 | NGO | 0.8912 |
467 | 1XA | 0.8912 |
468 | 4JQ | 0.8911 |
469 | XG1 | 0.8910 |
470 | 4XF | 0.8910 |
471 | GRX | 0.8910 |
472 | SKM | 0.8910 |
473 | JR2 | 0.8909 |
474 | 6FB | 0.8909 |
475 | MQN | 0.8909 |
476 | 4VY | 0.8908 |
477 | E7S | 0.8908 |
478 | 4R1 | 0.8907 |
479 | SJK | 0.8907 |
480 | 3Z8 | 0.8907 |
481 | BHA | 0.8907 |
482 | J6W | 0.8906 |
483 | 5JL | 0.8906 |
484 | 4M0 | 0.8905 |
485 | 091 | 0.8905 |
486 | DOB | 0.8904 |
487 | BG6 | 0.8904 |
488 | 5GT | 0.8903 |
489 | 4FH | 0.8903 |
490 | 9GP | 0.8902 |
491 | 4XS | 0.8902 |
492 | X0V | 0.8902 |
493 | F69 | 0.8902 |
494 | NQ | 0.8901 |
495 | EKZ | 0.8901 |
496 | ANC | 0.8900 |
497 | B62 | 0.8900 |
498 | RXA | 0.8900 |
499 | LZ2 | 0.8900 |
500 | JAW | 0.8900 |
501 | 6FZ | 0.8900 |
502 | R9G | 0.8900 |
503 | P9P | 0.8899 |
504 | LZM | 0.8899 |
505 | RM1 | 0.8899 |
506 | 5CU | 0.8899 |
507 | 6HO | 0.8899 |
508 | N3W | 0.8899 |
509 | BP7 | 0.8898 |
510 | QSB | 0.8896 |
511 | NDG | 0.8896 |
512 | TZF | 0.8895 |
513 | VGD | 0.8895 |
514 | MMS | 0.8895 |
515 | 3HM | 0.8894 |
516 | OVP | 0.8893 |
517 | K2T | 0.8893 |
518 | M3Q | 0.8892 |
519 | GLC | 0.8892 |
520 | MAG | 0.8891 |
521 | DIU | 0.8890 |
522 | 8WO | 0.8890 |
523 | 7MU | 0.8889 |
524 | 9PY | 0.8889 |
525 | SX1 | 0.8888 |
526 | IPD | 0.8888 |
527 | BIO | 0.8887 |
528 | 54G | 0.8887 |
529 | HNK | 0.8886 |
530 | E1K | 0.8885 |
531 | K25 | 0.8885 |
532 | 1M2 | 0.8885 |
533 | LT2 | 0.8885 |
534 | HLD | 0.8884 |
535 | GJK | 0.8883 |
536 | 5NE | 0.8883 |
537 | 8S0 | 0.8883 |
538 | EVA | 0.8881 |
539 | HBI | 0.8880 |
540 | EYA | 0.8880 |
541 | GVY | 0.8879 |
542 | 4BL | 0.8879 |
543 | BGP | 0.8879 |
544 | 0P6 | 0.8876 |
545 | FTV | 0.8875 |
546 | YZM | 0.8875 |
547 | CLW | 0.8875 |
548 | INE | 0.8875 |
549 | NIZ | 0.8875 |
550 | 428 | 0.8874 |
551 | DHK | 0.8874 |
552 | IHB | 0.8873 |
553 | 60L | 0.8872 |
554 | SKF | 0.8872 |
555 | KDG | 0.8871 |
556 | 0FO | 0.8870 |
557 | L5V | 0.8870 |
558 | 1L5 | 0.8870 |
559 | 5M0 | 0.8869 |
560 | MRW | 0.8869 |
561 | CSN | 0.8869 |
562 | 3VW | 0.8869 |
563 | YE6 | 0.8867 |
564 | MAQ | 0.8867 |
565 | 5MK | 0.8867 |
566 | 2UD | 0.8867 |
567 | 86L | 0.8867 |
568 | TYE | 0.8867 |
569 | H2B | 0.8866 |
570 | C09 | 0.8865 |
571 | 64E | 0.8865 |
572 | 9TZ | 0.8865 |
573 | SNU | 0.8865 |
574 | 9F8 | 0.8865 |
575 | NEU | 0.8864 |
576 | 7ME | 0.8864 |
577 | 774 | 0.8863 |
578 | A5E | 0.8863 |
579 | 1HN | 0.8863 |
580 | CTL | 0.8862 |
581 | EV2 | 0.8861 |
582 | AJ1 | 0.8861 |
583 | 4AB | 0.8860 |
584 | TOF | 0.8860 |
585 | K22 | 0.8860 |
586 | 5NU | 0.8860 |
587 | ES5 | 0.8860 |
588 | NBG | 0.8859 |
589 | 4OG | 0.8858 |
590 | 2HC | 0.8858 |
591 | SLS | 0.8858 |
592 | PRF | 0.8858 |
593 | 4BX | 0.8857 |
594 | J5I | 0.8857 |
595 | 4FS | 0.8857 |
596 | 03V | 0.8856 |
597 | M1E | 0.8856 |
598 | DHR | 0.8856 |
599 | HA6 | 0.8855 |
600 | FBB | 0.8855 |
601 | G3E | 0.8853 |
602 | 8CM | 0.8852 |
603 | 3PF | 0.8851 |
604 | D48 | 0.8851 |
605 | 4AA | 0.8851 |
606 | MS0 | 0.8849 |
607 | 5WT | 0.8848 |
608 | I1E | 0.8848 |
609 | 78U | 0.8848 |
610 | DA4 | 0.8846 |
611 | DIN | 0.8846 |
612 | 37T | 0.8846 |
613 | DNA | 0.8846 |
614 | ESP | 0.8846 |
615 | GJP | 0.8845 |
616 | 2ZQ | 0.8845 |
617 | D80 | 0.8844 |
618 | R4E | 0.8844 |
619 | 3R4 | 0.8844 |
620 | 2F6 | 0.8844 |
621 | 36R | 0.8844 |
622 | 5RG | 0.8844 |
623 | YZ9 | 0.8843 |
624 | X0U | 0.8843 |
625 | A7W | 0.8843 |
626 | 1X7 | 0.8841 |
627 | OCH | 0.8840 |
628 | SE2 | 0.8838 |
629 | 4SX | 0.8838 |
630 | OIA | 0.8837 |
631 | ESX | 0.8837 |
632 | HQT | 0.8837 |
633 | OQC | 0.8837 |
634 | AOT | 0.8837 |
635 | AUV | 0.8836 |
636 | 7ZE | 0.8836 |
637 | CC5 | 0.8836 |
638 | MO8 | 0.8835 |
639 | 1VK | 0.8835 |
640 | JHY | 0.8834 |
641 | GDL | 0.8834 |
642 | IPB | 0.8834 |
643 | 263 | 0.8833 |
644 | ZZ2 | 0.8833 |
645 | P7Y | 0.8833 |
646 | 327 | 0.8833 |
647 | MYI | 0.8832 |
648 | DEE | 0.8831 |
649 | 4XV | 0.8831 |
650 | B2E | 0.8831 |
651 | HQJ | 0.8831 |
652 | ISZ | 0.8831 |
653 | BA5 | 0.8830 |
654 | 4BY | 0.8830 |
655 | 5BT | 0.8829 |
656 | JG8 | 0.8828 |
657 | 5WN | 0.8826 |
658 | IFP | 0.8826 |
659 | 4RU | 0.8825 |
660 | LLT | 0.8824 |
661 | 1QV | 0.8823 |
662 | PH3 | 0.8823 |
663 | QIV | 0.8822 |
664 | B21 | 0.8821 |
665 | 5F8 | 0.8821 |
666 | GCO | 0.8821 |
667 | C2U | 0.8821 |
668 | EY7 | 0.8821 |
669 | ICB | 0.8821 |
670 | 44V | 0.8820 |
671 | SYR | 0.8820 |
672 | 1AL | 0.8820 |
673 | BZ2 | 0.8819 |
674 | ZON | 0.8816 |
675 | DXK | 0.8816 |
676 | 2AQ | 0.8816 |
677 | MXD | 0.8815 |
678 | K44 | 0.8815 |
679 | 7B3 | 0.8815 |
680 | DTR | 0.8815 |
681 | HL4 | 0.8814 |
682 | P83 | 0.8813 |
683 | Y3L | 0.8813 |
684 | 5O6 | 0.8813 |
685 | YO5 | 0.8812 |
686 | K68 | 0.8812 |
687 | 9UG | 0.8811 |
688 | TYL | 0.8811 |
689 | GNR | 0.8810 |
690 | 96U | 0.8810 |
691 | 4JT | 0.8810 |
692 | JF1 | 0.8809 |
693 | PLP | 0.8809 |
694 | 7ZL | 0.8808 |
695 | HX4 | 0.8808 |
696 | B60 | 0.8808 |
697 | HNL | 0.8808 |
698 | BIK | 0.8807 |
699 | 4Z9 | 0.8807 |
700 | 8G6 | 0.8807 |
701 | 5RO | 0.8806 |
702 | 9LI | 0.8806 |
703 | 60Q | 0.8806 |
704 | GAL | 0.8806 |
705 | H70 | 0.8805 |
706 | 8WZ | 0.8805 |
707 | 2KA | 0.8805 |
708 | P9E | 0.8805 |
709 | F12 | 0.8804 |
710 | RVE | 0.8803 |
711 | 22L | 0.8802 |
712 | 344 | 0.8802 |
713 | 6DP | 0.8802 |
714 | HRM | 0.8801 |
715 | TYR | 0.8801 |
716 | 2FX | 0.8800 |
717 | 3RI | 0.8800 |
718 | ZEC | 0.8800 |
719 | 5B2 | 0.8799 |
720 | CCV | 0.8799 |
721 | B1J | 0.8798 |
722 | C1M | 0.8798 |
723 | COU | 0.8798 |
724 | 96Z | 0.8797 |
725 | 46P | 0.8797 |
726 | GXY | 0.8797 |
727 | CTE | 0.8797 |
728 | 1FE | 0.8796 |
729 | K3Q | 0.8796 |
730 | PQT | 0.8795 |
731 | H42 | 0.8795 |
732 | K32 | 0.8794 |
733 | 64C | 0.8794 |
734 | L98 | 0.8793 |
735 | 8RK | 0.8793 |
736 | JU2 | 0.8793 |
737 | BHO | 0.8793 |
738 | UFV | 0.8793 |
739 | PMP | 0.8793 |
740 | DUR | 0.8792 |
741 | RKV | 0.8792 |
742 | CLU | 0.8792 |
743 | H7S | 0.8791 |
744 | DDU | 0.8791 |
745 | ET2 | 0.8791 |
746 | EVF | 0.8791 |
747 | B61 | 0.8790 |
748 | AN3 | 0.8790 |
749 | NPL | 0.8789 |
750 | NGT | 0.8789 |
751 | NGW | 0.8789 |
752 | 5QX | 0.8789 |
753 | MZM | 0.8789 |
754 | GJZ | 0.8789 |
755 | 6RQ | 0.8788 |
756 | CFI | 0.8788 |
757 | XFE | 0.8787 |
758 | 67X | 0.8786 |
759 | EYK | 0.8785 |
760 | DBX | 0.8785 |
761 | NDH | 0.8785 |
762 | ZZA | 0.8784 |
763 | 3ZB | 0.8784 |
764 | 2EC | 0.8782 |
765 | FEH | 0.8782 |
766 | XI7 | 0.8780 |
767 | SKA | 0.8780 |
768 | 12Q | 0.8780 |
769 | GZL | 0.8780 |
770 | TZM | 0.8780 |
771 | 2LP | 0.8779 |
772 | S0E | 0.8778 |
773 | 0W1 | 0.8777 |
774 | TGX | 0.8777 |
775 | 5MD | 0.8776 |
776 | YPN | 0.8776 |
777 | OTD | 0.8776 |
778 | 1AJ | 0.8775 |
779 | F5C | 0.8775 |
780 | M2K | 0.8773 |
781 | 1XS | 0.8772 |
782 | 7W1 | 0.8772 |
783 | 12T | 0.8772 |
784 | ONZ | 0.8772 |
785 | FE DB1 | 0.8772 |
786 | HWH | 0.8772 |
787 | MWP | 0.8772 |
788 | U7E | 0.8771 |
789 | 0OL | 0.8771 |
790 | HC4 | 0.8770 |
791 | LI6 | 0.8770 |
792 | BDI | 0.8769 |
793 | LTN | 0.8769 |
794 | GT4 | 0.8768 |
795 | X0T | 0.8768 |
796 | 5VM | 0.8768 |
797 | 8MO | 0.8768 |
798 | DPZ | 0.8767 |
799 | YF3 | 0.8765 |
800 | 0OY | 0.8765 |
801 | FBM | 0.8765 |
802 | 657 | 0.8764 |
803 | 6L6 | 0.8764 |
804 | UNJ | 0.8764 |
805 | X04 | 0.8764 |
806 | ATX | 0.8763 |
807 | 36E | 0.8763 |
808 | AVA | 0.8762 |
809 | KJH | 0.8762 |
810 | 3LJ | 0.8762 |
811 | YRL | 0.8761 |
812 | G1P | 0.8761 |
813 | EYM | 0.8760 |
814 | RA7 | 0.8760 |
815 | FOT | 0.8759 |
816 | TB8 | 0.8759 |
817 | 61O | 0.8759 |
818 | KCH | 0.8758 |
819 | BGN | 0.8758 |
820 | 52F | 0.8758 |
821 | 27K | 0.8758 |
822 | X11 | 0.8757 |
823 | M02 | 0.8756 |
824 | MPP | 0.8755 |
825 | BZQ | 0.8755 |
826 | PPY | 0.8755 |
827 | 1XM | 0.8754 |
828 | ENO | 0.8754 |
829 | FHC | 0.8754 |
830 | NSG | 0.8753 |
831 | 3DO | 0.8753 |
832 | 6TZ | 0.8753 |
833 | 4FE | 0.8752 |
834 | NFZ | 0.8751 |
835 | 5C1 | 0.8751 |
836 | ITW | 0.8751 |
837 | Q5M | 0.8750 |
838 | I4D | 0.8750 |
839 | DX3 | 0.8749 |
840 | 173 | 0.8748 |
841 | 9DG | 0.8747 |
842 | AEF | 0.8747 |
843 | PLR | 0.8747 |
844 | BCP | 0.8745 |
845 | 54Z | 0.8745 |
846 | 39U | 0.8743 |
847 | KT7 | 0.8743 |
848 | SCT | 0.8743 |
849 | FWB | 0.8741 |
850 | 6CS | 0.8741 |
851 | PPT | 0.8741 |
852 | 8MP | 0.8740 |
853 | R20 | 0.8739 |
854 | EUH | 0.8737 |
855 | ZYQ | 0.8737 |
856 | 258 | 0.8737 |
857 | XIY | 0.8737 |
858 | G14 | 0.8736 |
859 | LT8 | 0.8736 |
860 | FUD | 0.8736 |
861 | BY5 | 0.8736 |
862 | 3Y7 | 0.8735 |
863 | 3IB | 0.8734 |
864 | 7PJ | 0.8734 |
865 | KJY | 0.8734 |
866 | A1Y | 0.8733 |
867 | 15L | 0.8733 |
868 | QUS | 0.8733 |
869 | N9J | 0.8733 |
870 | ABF | 0.8733 |
871 | KTJ | 0.8733 |
872 | 1SS | 0.8732 |
873 | OA3 | 0.8732 |
874 | SQ7 | 0.8732 |
875 | 268 | 0.8731 |
876 | NQH | 0.8730 |
877 | 2D0 | 0.8729 |
878 | BNF | 0.8729 |
879 | HPP | 0.8729 |
880 | 0LO | 0.8728 |
881 | M1Q | 0.8728 |
882 | BNX | 0.8727 |
883 | LIP | 0.8727 |
884 | QSH | 0.8725 |
885 | FP1 | 0.8725 |
886 | 505 | 0.8724 |
887 | ENG | 0.8724 |
888 | Q88 | 0.8723 |
889 | 3IT | 0.8723 |
890 | C53 | 0.8722 |
891 | GC3 | 0.8721 |
892 | B0K | 0.8721 |
893 | BHS | 0.8720 |
894 | NGA | 0.8720 |
895 | QH3 | 0.8719 |
896 | 5WZ | 0.8718 |
897 | YH7 | 0.8718 |
898 | 261 | 0.8718 |
899 | 36Y | 0.8718 |
900 | PQZ | 0.8717 |
901 | JTH | 0.8717 |
902 | NWD | 0.8717 |
903 | 2KU | 0.8716 |
904 | TWO | 0.8716 |
905 | 3BU | 0.8716 |
906 | ZYW | 0.8715 |
907 | 537 | 0.8715 |
908 | LGC | 0.8715 |
909 | TIY | 0.8714 |
910 | 27B | 0.8714 |
911 | D1Y | 0.8714 |
912 | BPU | 0.8713 |
913 | LFQ | 0.8713 |
914 | SOR | 0.8713 |
915 | LSQ | 0.8712 |
916 | EN1 | 0.8710 |
917 | JYE | 0.8710 |
918 | BOA | 0.8709 |
919 | 6AP | 0.8709 |
920 | LOG | 0.8709 |
921 | GI3 | 0.8708 |
922 | G12 | 0.8707 |
923 | XQG | 0.8707 |
924 | NCT | 0.8707 |
925 | J9W | 0.8706 |
926 | XCG | 0.8706 |
927 | CS2 | 0.8706 |
928 | 78Y | 0.8705 |
929 | UNC | 0.8705 |
930 | PYQ | 0.8705 |
931 | QUB | 0.8704 |
932 | 1SV | 0.8704 |
933 | 5VJ | 0.8704 |
934 | 4P5 | 0.8704 |
935 | A5H | 0.8704 |
936 | RNO | 0.8704 |
937 | N2M | 0.8702 |
938 | 14W | 0.8702 |
939 | CWM | 0.8701 |
940 | PRL | 0.8701 |
941 | P1J | 0.8701 |
942 | GCW | 0.8700 |
943 | 5PX | 0.8700 |
944 | AZM | 0.8700 |
945 | 6E8 | 0.8700 |
946 | DX4 | 0.8699 |
947 | 0CU | 0.8699 |
948 | LJ3 | 0.8698 |
949 | TJM | 0.8697 |
950 | SNO | 0.8697 |
951 | GV9 | 0.8694 |
952 | 5FL | 0.8692 |
953 | SNG | 0.8692 |
954 | PXP | 0.8690 |
955 | CFF | 0.8690 |
956 | 20J | 0.8690 |
957 | 1HR | 0.8690 |
958 | FIX | 0.8689 |
959 | GSY | 0.8689 |
960 | KGK | 0.8689 |
961 | REL | 0.8688 |
962 | IJZ | 0.8688 |
963 | GOJ | 0.8688 |
964 | EUE | 0.8686 |
965 | 6GU | 0.8686 |
966 | BGU | 0.8686 |
967 | MQG | 0.8686 |
968 | X09 | 0.8684 |
969 | EMZ | 0.8684 |
970 | JXN | 0.8684 |
971 | KBG | 0.8684 |
972 | FK8 | 0.8684 |
973 | M3H | 0.8683 |
974 | CTS | 0.8683 |
975 | GTR | 0.8683 |
976 | SG2 | 0.8682 |
977 | ZSP | 0.8680 |
978 | PHH | 0.8680 |
979 | 3LR | 0.8679 |
980 | GUN | 0.8678 |
981 | 3SU | 0.8677 |
982 | B2T | 0.8677 |
983 | QX4 | 0.8677 |
984 | QIF | 0.8674 |
985 | L7T | 0.8674 |
986 | 141 | 0.8672 |
987 | XM5 | 0.8672 |
988 | 582 | 0.8671 |
989 | GNM | 0.8671 |
990 | SHG | 0.8671 |
991 | 6SD | 0.8670 |
992 | B86 | 0.8670 |
993 | AZA | 0.8669 |
994 | F1X | 0.8669 |
995 | OCZ | 0.8667 |
996 | 6R8 | 0.8665 |
997 | PNZ | 0.8664 |
998 | EUG | 0.8662 |
999 | B5D | 0.8661 |
1000 | D1G | 0.8660 |
1001 | KYN | 0.8660 |
1002 | 9KT | 0.8660 |
1003 | TTL | 0.8660 |
1004 | 7O4 | 0.8660 |
1005 | AZG | 0.8658 |
1006 | M1Z | 0.8658 |
1007 | IPT | 0.8658 |
1008 | 2LW | 0.8657 |
1009 | ES0 | 0.8657 |
1010 | 5LA | 0.8657 |
1011 | BE2 | 0.8657 |
1012 | 4B0 | 0.8655 |
1013 | M6P | 0.8655 |
1014 | AX3 | 0.8654 |
1015 | F2W | 0.8653 |
1016 | PQK | 0.8653 |
1017 | C82 | 0.8653 |
1018 | IYR | 0.8653 |
1019 | FGZ | 0.8651 |
1020 | SYV | 0.8651 |
1021 | ZEA | 0.8651 |
1022 | ZZ8 | 0.8650 |
1023 | HKD | 0.8650 |
1024 | 0FR | 0.8649 |
1025 | A2F | 0.8649 |
1026 | GT0 | 0.8648 |
1027 | AC6 | 0.8648 |
1028 | CHQ | 0.8647 |
1029 | 4AU | 0.8645 |
1030 | SAL | 0.8644 |
1031 | GLO | 0.8644 |
1032 | TMG | 0.8644 |
1033 | PIM | 0.8643 |
1034 | IGA | 0.8642 |
1035 | JFJ | 0.8642 |
1036 | CUQ | 0.8641 |
1037 | HNQ | 0.8640 |
1038 | B23 | 0.8640 |
1039 | TTY | 0.8640 |
1040 | Q71 | 0.8639 |
1041 | WOO | 0.8639 |
1042 | AHC | 0.8639 |
1043 | ALL | 0.8638 |
1044 | JKE | 0.8638 |
1045 | 4M4 | 0.8637 |
1046 | TU0 | 0.8636 |
1047 | F40 | 0.8636 |
1048 | THU | 0.8635 |
1049 | LPK | 0.8635 |
1050 | WUB | 0.8634 |
1051 | IBM | 0.8634 |
1052 | KG1 | 0.8633 |
1053 | SYM | 0.8633 |
1054 | KP2 | 0.8631 |
1055 | NIY | 0.8631 |
1056 | Q7A | 0.8631 |
1057 | RZH | 0.8631 |
1058 | J01 | 0.8631 |
1059 | EXL | 0.8629 |
1060 | QQQ | 0.8628 |
1061 | ZXD | 0.8627 |
1062 | F95 | 0.8627 |
1063 | IQZ | 0.8625 |
1064 | J1K | 0.8625 |
1065 | X0W | 0.8625 |
1066 | 42C | 0.8625 |
1067 | ANN | 0.8624 |
1068 | PF1 | 0.8623 |
1069 | JXQ | 0.8623 |
1070 | 4LW | 0.8622 |
1071 | KWB | 0.8621 |
1072 | HSX | 0.8621 |
1073 | Q77 | 0.8620 |
1074 | 8XQ | 0.8620 |
1075 | 2CZ | 0.8618 |
1076 | MPV | 0.8618 |
1077 | AZC | 0.8617 |
1078 | 5WX | 0.8616 |
1079 | 4ZA | 0.8615 |
1080 | AIN | 0.8615 |
1081 | 0J5 | 0.8615 |
1082 | R2P | 0.8613 |
1083 | CIT | 0.8612 |
1084 | 2J9 | 0.8611 |
1085 | 8YH | 0.8611 |
1086 | LKA | 0.8611 |
1087 | 6MW | 0.8610 |
1088 | 3MG | 0.8610 |
1089 | NPO | 0.8610 |
1090 | AKH | 0.8610 |
1091 | PIQ | 0.8609 |
1092 | DTE | 0.8608 |
1093 | 7WV | 0.8608 |
1094 | 0BP | 0.8607 |
1095 | B57 | 0.8606 |
1096 | HJ7 | 0.8605 |
1097 | NDM | 0.8605 |
1098 | XIZ | 0.8605 |
1099 | 2QC | 0.8605 |
1100 | XQI | 0.8604 |
1101 | BZE | 0.8604 |
1102 | PZP | 0.8604 |
1103 | TPA | 0.8603 |
1104 | DPT | 0.8603 |
1105 | X05 | 0.8602 |
1106 | 3GX | 0.8601 |
1107 | ELH | 0.8600 |
1108 | K97 | 0.8600 |
1109 | 549 | 0.8600 |
1110 | 7NI | 0.8599 |
1111 | Q6T | 0.8599 |
1112 | TOM | 0.8599 |
1113 | K3D | 0.8598 |
1114 | N4E | 0.8598 |
1115 | G5V | 0.8598 |
1116 | L21 | 0.8597 |
1117 | 5JT | 0.8595 |
1118 | PX7 | 0.8594 |
1119 | MOK | 0.8593 |
1120 | AH9 | 0.8593 |
1121 | PHB | 0.8593 |
1122 | II4 | 0.8592 |
1123 | CGW | 0.8591 |
1124 | F9P | 0.8590 |
1125 | ROI | 0.8590 |
1126 | SDD | 0.8587 |
1127 | NAL | 0.8587 |
1128 | 56D | 0.8587 |
1129 | LP8 | 0.8586 |
1130 | 67N | 0.8585 |
1131 | X6P | 0.8585 |
1132 | S2T | 0.8585 |
1133 | CPW | 0.8585 |
1134 | NOK | 0.8584 |
1135 | TVP | 0.8582 |
1136 | 4WL | 0.8582 |
1137 | 3HA | 0.8582 |
1138 | HNT | 0.8581 |
1139 | 53C | 0.8581 |
1140 | 2D3 | 0.8579 |
1141 | STT | 0.8578 |
1142 | DBH | 0.8576 |
1143 | LRW | 0.8575 |
1144 | 5NN | 0.8575 |
1145 | KTA | 0.8575 |
1146 | C0H | 0.8573 |
1147 | PAB | 0.8573 |
1148 | 3AD | 0.8572 |
1149 | EV0 | 0.8571 |
1150 | KNA | 0.8568 |
1151 | GNY | 0.8568 |
1152 | 1Z6 | 0.8568 |
1153 | GLP | 0.8567 |
1154 | PBZ | 0.8566 |
1155 | RJY | 0.8566 |
1156 | V55 | 0.8564 |
1157 | IA2 | 0.8562 |
1158 | FDB | 0.8560 |
1159 | J9N | 0.8558 |
1160 | PIY | 0.8557 |
1161 | F0J | 0.8554 |
1162 | PO6 | 0.8552 |
1163 | LWS | 0.8551 |
1164 | HLP | 0.8550 |
1165 | EVO | 0.8549 |
1166 | GAB | 0.8549 |
1167 | T6Z | 0.8548 |
1168 | FYU | 0.8545 |
1169 | PZI | 0.8542 |
1170 | 1Y6 | 0.8541 |
1171 | 3HB | 0.8540 |
1172 | 3AB | 0.8540 |
1173 | TEP | 0.8540 |
1174 | TCA | 0.8539 |
1175 | AS3 | 0.8539 |
1176 | HBD | 0.8538 |
1177 | 0W8 | 0.8535 |
1178 | PBN | 0.8534 |
1179 | GB4 | 0.8534 |
1180 | 3U4 | 0.8521 |
1181 | 4SV | 0.8511 |
1182 | 4MA | 0.8504 |
This union binding pocket(no: 2) in the query (biounit: 6ay3.bio1) has 17 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4UYF | 73B | 41.7391 |