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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 15 families. | |||||
1 | 1REK | Ki = 200 nM | B8L | C32 H36 N2 O7 | CC[C@H](C).... |
2 | 6SOX | - | LQ2 | C8 H7 N O3 | c1cc(ccc1C.... |
3 | 3BWJ | Kd = 0.319 uM | ARX | C28 H47 N15 O7 | [H]/N=C(N).... |
4 | 6SPS | - | LR5 | C8 H6 F3 N O | c1cc(ccc1C.... |
5 | 6SPM | - | 3AE | C8 H5 F3 O2 | c1cc(ccc1C.... |
6 | 3AGL | Ki = 16 nM | A03 | C37 H63 N17 O9 | [H]/N=C(N).... |
7 | 6SNX | - | UNU | C7 H7 N O | c1ccc(cc1).... |
8 | 6ZN0 | - | NTN | C6 H7 N3 | c1cnccc1C(.... |
9 | 6SNN | - | BEZ | C7 H6 O2 | c1ccc(cc1).... |
10 | 1RE8 | Ki = 0.3 nM | BD2 | C27 H26 N2 O6 | c1ccc(c(c1.... |
11 | 1SZM | ic50 = 2.94 uM | BI4 | C27 H26 N4 O2 | C[N@]1CCC[.... |
12 | 1REJ | Ki = 5 nM | B1L | C20 H22 N2 O5 | c1cc(ccc1C.... |
13 | 6SPY | - | LR8 | C10 H13 N3 O2 | c1cc(ncc1C.... |
14 | 6Z08 | - | NPO | C6 H5 N O3 | c1cc(ccc1[.... |
15 | 5IZJ | - | 6J9 | C10 H13 N5 | c1c[nH]c2c.... |
16 | 3AG9 | Ki = 9 nM | A02 | C40 H70 N18 O9 | [H]/N=C(N).... |
17 | 5IZF | Kd = 0.18 nM | 6J9 AZ1 DAR ACA DAR NH2 | n/a | n/a |
18 | 6YPS | - | P72 | C7 H8 N2 O | [H]/N=C(c1.... |
19 | 6Z44 | - | IPH | C6 H6 O | c1ccc(cc1).... |
20 | 6SPU | - | GAB | C7 H7 N O2 | c1cc(cc(c1.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 70 families. | |||||
1 | 2YM8 | ic50 = 0.013 uM | YM8 | C19 H19 Cl N6 O | C[C@H](CN(.... |
2 | 5OPU | Ki = 0.053 uM | A3K | C15 H12 N4 | Cc1cccc(c1.... |
3 | 5OP4 | Ki = 0.194 uM | A0T | C19 H21 F4 N5 O3 | CCNc1c(cnc.... |
4 | 2CGW | ic50 = 17.3 uM | 3C3 | C9 H15 N9 O2 | CCCn1c(nc(.... |
5 | 3F9N | ic50 = 1.3 uM | 38M | C29 H35 Cl N4 O2 S | CCCC[C@@H].... |
6 | 4JIK | ic50 = 0.018 uM | 1KO | C18 H19 Cl N6 O | c1cc(ccc1c.... |
7 | 4QYH | ic50 = 0.0013 uM | 3DX | C22 H20 N6 | CN1CCN(CC1.... |
8 | 2BRB | Ki = 13.7 uM | PFQ | C20 H17 N3 O2 | c1ccc(cc1).... |
9 | 3PA3 | ic50 = 1 nM | C70 | C18 H18 Cl N5 O S | c1cc(ccc1c.... |
10 | 5OQ6 | Ki = 0.0277 uM | 4K4 | C31 H38 N8 O3 | CN1CCN(CC1.... |
11 | 6FCF | ic50 = 0.006 uM | D58 | C20 H22 N4 O S | C[C@@H]1[C.... |
12 | 2YER | ic50 = 0.02 uM | TQ1 | C15 H12 N4 O2 | c1cc([nH]c.... |
13 | 2E9O | ic50 = 20 nM | A58 | C25 H27 N3 O2 | CC1CCC(CC1.... |
14 | 5OPB | Ki = 0.0241 uM | A1N | C21 H25 N5 O2 | C[C@@H]1CN.... |
15 | 2WMQ | - | ZYQ | C9 H11 N3 O2 S | CC(=O)Nc1n.... |
16 | 2BRO | ic50 = 1.4 uM | DF2 | C21 H20 N4 O2 | c1ccc(cc1).... |
17 | 2QHN | ic50 = 980 nM | 582 | C13 H13 N3 O | CCN1c2cccc.... |
18 | 4RVM | ic50 = 1 nM | 3X7 | C23 H21 N5 | c1cc(ccc1C.... |
19 | 5DLS | ic50 = 4.4 nM | 5CV | C31 H34 N6 O3 | CC(C)(CN(C.... |
20 | 3TKI | ic50 = 0.05 nM | S25 | C20 H23 N7 O2 S | c1cnc(cc1N.... |
21 | 2YM5 | ic50 = 0.43 uM | YM5 | C18 H21 N5 O2 | c1cc(cc(c1.... |
22 | 4HYH | ic50 = 1 nM | 1AM | C22 H22 N6 O3 S | COc1ccc2c(.... |
23 | 5OPV | Ki = 0.0515 uM | A3H | C19 H16 N6 | Cc1cccc(c1.... |
24 | 5OOT | Ki = 0.0285 uM | 4K4 | C31 H38 N8 O3 | CN1CCN(CC1.... |
25 | 1NVS | Ki = 15 nM | UCM | C24 H15 N3 O3 | c1ccc2c(c1.... |
26 | 2YDK | ic50 = 0.007 uM | YDK | C17 H20 N4 O2 S | c1ccc(cc1).... |
27 | 3OT3 | ic50 = 0.005 uM | 22K | C16 H20 Br N7 | Cn1cc(cn1).... |
28 | 2HXQ | ic50 = 144 nM | 373 | C24 H26 N4 O | c1ccc2c(c1.... |
29 | 2QHM | ic50 = 660 nM | 7CS | C16 H19 N3 O2 | CN1[C@H]2C.... |
30 | 2BRH | ic50 = 22.9 uM | DFW | C20 H15 N3 O3 | c1ccc(cc1).... |
31 | 2R0U | ic50 = 1 nM | M54 | C25 H22 N4 O2 | c1cc(cc(c1.... |
32 | 1NVR | Ki = 7.8 nM | STU | C28 H26 N4 O3 | C[C@@]12[C.... |
33 | 3OT8 | ic50 = 0.009 uM | MI5 | C19 H22 N8 S | Cc1cc(sn1).... |
34 | 2YM4 | ic50 = 1.5 uM | 4YM | C21 H22 N6 O3 | CCOC(=O)c1.... |
35 | 4HYI | ic50 = 3 nM | 1AO | C21 H20 N6 O S | c1ccc2c(c1.... |
36 | 4RVL | ic50 = 41.7 nM | 3XL | C17 H10 N4 O | c1ccc(c(c1.... |
37 | 5JQ5 | Kd = 2341 nM | I74 | C22 H30 N6 O | CC(C)c1cnn.... |
38 | 2C6O | - | 4SP | C18 H22 N6 O3 S | c1cc(ccc1N.... |
39 | 1V1K | ic50 = 35 uM | 3FP | C22 H23 F4 N5 O2 | CN(C)C[C@H.... |
40 | 2VTJ | ic50 = 1.9 uM | LZ4 | C10 H9 Cl N4 O2 S | c1cc(ccc1N.... |
41 | 3EZV | - | EZV | C25 H25 N7 | CN1CCN(CC1.... |
42 | 3PXZ | Kd = 37 uM | 2AN | C16 H13 N O3 S | c1ccc(cc1).... |
43 | 1W0X | - | OLO | C15 H18 N6 O | Cn1cnc2c1n.... |
44 | 2XMY | Ki = 0.11 nM | CDK | C18 H21 N5 O4 S2 | CC1=C(SC(=.... |
45 | 2UZO | ic50 = 27 uM | C62 | C14 H10 N2 O5 S2 | c1cc(ccc1c.... |
46 | 1KE7 | ic50 = 8.9 nM | LS3 | C20 H15 N3 O4 S | c1cc2c(cc1.... |
47 | 1DM2 | - | HMD | C11 H10 Br N5 O2 | C1CNC(=O)C.... |
48 | 1DI8 | ic50 = 1 uM | DTQ | C16 H15 N3 O3 | COc1cc2c(c.... |
49 | 5JQ8 | - | I73 | C22 H30 N6 O | CC(C)c1cnn.... |
50 | 6Q4H | - | HGH | C13 H11 N5 O3 | c1cc(cc(c1.... |
51 | 1GIJ | - | 2PU | C19 H22 N6 O2 | c1cc2c(c(c.... |
52 | 2R3P | ic50 = 900 nM | 3SC | C19 H12 Cl2 N6 S | c1cc(c(c(c.... |
53 | 1KE8 | ic50 = 1000 nM | LS4 | C18 H14 N4 O3 S2 | c1ccc2c(c1.... |
54 | 2C6I | ic50 = 11 uM | DT1 | C18 H22 N6 O3 S | c1cc(ccc1N.... |
55 | 1PXP | Ki = 0.22 uM | CK8 | C17 H19 N5 S | Cc1c(sc(n1.... |
56 | 6Q3C | - | BYZ | C3 H3 Br N2 | c1c(cn[nH].... |
57 | 2UZN | ic50 = 0.03 uM | C96 | C15 H13 N3 O4 S2 | [H]/N=C/1N.... |
58 | 2B55 | ic50 = 96 nM | D31 | C24 H31 N5 O2 | c1cc-2c(c(.... |
59 | 5K4J | - | 6QB | C21 H18 Cl F N6 O2 | Cn1c(ccn1).... |
60 | 3PJ8 | - | 404 | C19 H26 N6 O | CC[C@H](CO.... |
61 | 3LFQ | - | A28 | C17 H15 F2 N3 O | CCCC(=O)Nc.... |
62 | 2W05 | ic50 = 0.001 uM | FRT | C20 H26 N6 O3 S | Cc1ncc(n1C.... |
63 | 2XNB | Ki = 149 nM | Y8L | C19 H22 N6 O S | CC1=C(SC(=.... |
64 | 1HCK | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
65 | 5IEX | - | 6AF | C17 H21 Br N4 O3 S | C[C@H]([C@.... |
66 | 2R3H | ic50 = 20000 nM | SCE | C13 H13 N5 | Cc1cnc2n1c.... |
67 | 5LI9 | - | ACP | C11 H18 N5 O12 P3 | c1nc(c2c(n.... |
68 | 3A8W | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
69 | 3OWL | ic50 = 0.67 uM | 19E | C16 H11 Cl N2 O | Cc1cnc(c2c.... |
70 | 5OYF | - | B4Q | C25 H27 N3 | CCc1ccccc1.... |
71 | 5H8G | Kd = 48.2 pM | 5Y4 | C23 H29 N9 O | CC(=O)Nc1c.... |
72 | 5OS7 | - | A8Q | C16 H19 Cl N | CC(C)c1ccc.... |
73 | 6YPJ | - | P5W | C16 H12 N2 O2 S | c1ccc(cc1).... |
74 | 5OTZ | Kd = 6.5 uM | AUT | C15 H15 Cl2 N | CCc1ccccc1.... |
75 | 6HOQ | - | FER | C10 H10 O4 | COc1cc(ccc.... |
76 | 5OUM | - | AVK | C18 H18 Cl N3 | c1ccc(cc1).... |
77 | 5B0X | ic50 = 0.02 uM | HCK | C18 H14 N2 O4 S | COc1ccc(cc.... |
78 | 5MO8 | Kd = 1.64 uM | C98 | C26 H26 Cl N3 O4 | c1ccc(cc1).... |
79 | 6RCB | ic50 = 0.33 uM | JYZ | C17 H14 N2 O4 | COc1cc(ccc.... |
80 | 3R1N | - | 05B | C22 H21 N5 O3 | c1cc2c(cc1.... |
81 | 3BWJ | Kd = 0.319 uM | ARX | C28 H47 N15 O7 | [H]/N=C(N).... |
82 | 6SPS | - | LR5 | C8 H6 F3 N O | c1cc(ccc1C.... |
83 | 6SPM | - | 3AE | C8 H5 F3 O2 | c1cc(ccc1C.... |
84 | 3AGL | Ki = 16 nM | A03 | C37 H63 N17 O9 | [H]/N=C(N).... |
85 | 6SNX | - | UNU | C7 H7 N O | c1ccc(cc1).... |
86 | 6ZN0 | - | NTN | C6 H7 N3 | c1cnccc1C(.... |
87 | 6SNN | - | BEZ | C7 H6 O2 | c1ccc(cc1).... |
88 | 1RE8 | Ki = 0.3 nM | BD2 | C27 H26 N2 O6 | c1ccc(c(c1.... |
89 | 1SZM | ic50 = 2.94 uM | BI4 | C27 H26 N4 O2 | C[N@]1CCC[.... |
90 | 1REJ | Ki = 5 nM | B1L | C20 H22 N2 O5 | c1cc(ccc1C.... |
91 | 6SPY | - | LR8 | C10 H13 N3 O2 | c1cc(ncc1C.... |
92 | 6Z08 | - | NPO | C6 H5 N O3 | c1cc(ccc1[.... |
93 | 2Z7Q | - | ACP | C11 H18 N5 O12 P3 | c1nc(c2c(n.... |
94 | 1MQ4 | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
95 | 6C2R | Ki = 0.8 nM | EG7 | C24 H26 Cl F2 N5 O2 | Cc1cc(n[nH.... |
96 | 5EW9 | Ki < 0.01 nM | 5VC | C22 H21 Cl F N3 O3 S | c1cc(nc(c1.... |
97 | 5ORY | Kd = 357 uM | AY4 | C9 H6 F2 N2 O | c1c[nH]nc1.... |
98 | 4CEG | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
99 | 6VPH | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
100 | 5ORV | Kd = 1297 uM | A65 | C6 H9 N O S3 | CSc1c(c(sn.... |
101 | 5OS6 | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
102 | 3DJ6 | - | AK6 | C25 H24 N4 O3 S | COc1ccc(cc.... |
103 | 5OSF | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
104 | 2WQE | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
105 | 6CPF | - | ACP | C11 H18 N5 O12 P3 | c1nc(c2c(n.... |
106 | 6R4C | - | JRQ | C16 H22 N2 O3 | CCOC(=O)C[.... |
107 | 3FDN | ic50 = 0.033 uM | MMH | C21 H22 N6 O3 | Cc1c(c([nH.... |
108 | 5OOI | - | 9YE | C23 H25 N O3 | CC(C)n1c2c.... |
109 | 7A1Z | ic50 = 3.38 uM | QWN | C5 H2 Br Cl N4 | c1c2c(nc(c.... |
110 | 3KXH | - | K66 | C11 H9 Br4 N3 O2 | CN(C)c1nc2.... |
111 | 4DGM | ic50 = 1.2 uM | AGI | C15 H10 O5 | c1cc(ccc1C.... |
112 | 3PVG | - | K68 | C9 H4 Br4 N2 O2 | c1nc2c(n1C.... |
113 | 1ZOG | Ki = 0.07 uM | K37 | C8 H4 Br4 N2 S | CSc1[nH]c2.... |
114 | 2PVJ | Ki = 0.005 uM | P44 | C19 H21 N7 | c1ccc(cc1).... |
115 | 1P4F | - | DRG | C12 H11 N3 | c1ccc-2c(c.... |
116 | 4TXC | Kd = 0.24 uM | 38G | C24 H27 N5 O3 | CN(C)CCN[C.... |
117 | 2YAK | ic50 = 2 nM | OSV | C27 H31 F N4 O3 Ru S4 | CC(C)Oc1cc.... |
118 | 5AUY | ic50 = 1.6 uM | MRI | C15 H10 O7 | c1cc(c(cc1.... |
119 | 2HY0 | ic50 = 0.65 nM | 306 | C26 H25 N5 O | c1cc2c(cc1.... |
120 | 5LVO | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
121 | 4XX9 | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
122 | 2XCK | ic50 = 713 nM | MH4 | C29 H33 N9 O | Cc1cc(ccn1.... |
123 | 3QD4 | ic50 = 6.31 nM | 3Q6 | C22 H30 N8 O2 | C[C@@H]1C[.... |
124 | 3RCJ | ic50 = 0.8 uM | 3RC | C16 H13 N5 | c1ccc(cc1).... |
125 | 2PE0 | - | 39Z | C14 H12 N2 O2 | CC(c1ccc[n.... |
126 | 4CT2 | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
127 | 5ACK | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
128 | 3HRC | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
129 | 5LVM | - | ADE | C5 H5 N5 | c1[nH]c2c(.... |
130 | 5MRD | ic50 = 36.4 uM | S26 | C18 H13 Cl N2 O4 S2 | CCOC(=O)C1.... |
131 | 3ION | ic50 = 8 nM | 8H1 | C28 H27 N5 O3 | COc1cc2c3c.... |
132 | 1UU7 | ic50 = 14 uM | BI2 | C27 H26 N4 O2 | C[N@@]1CCC.... |
133 | 3HRF | Kd = 10.3 uM | P47 | C17 H15 Cl O2 | c1ccc(cc1).... |
134 | 3QCS | ic50 = 0.316 uM | 3Q1 | C15 H17 N7 O | c1cc2c(cc1.... |
135 | 1H1W | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
136 | 4AW1 | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
137 | 2PE2 | - | 464 | C28 H30 N6 O3 | c1cc(cc(c1.... |
138 | 3H9O | ic50 = 70 nM | 9BD | C19 H19 N5 O3 | COCCOc1cc2.... |
139 | 3QD3 | ic50 = 0.00000001 M | 3Q5 | C22 H30 N8 O2 | C[C@H]1CC[.... |
140 | 1OKY | ic50 = 6.5 nM | STU | C28 H26 N4 O3 | C[C@@]12[C.... |
141 | 3IOP | ic50 = 17 nM | 8I1 | C28 H27 N5 O3 | COc1cc2c3c.... |
142 | 2PE1 | ic50 = 6 nM | 517 | C15 H14 N4 O2 | CC(c1ccc[n.... |
143 | 3RWP | Ki = 0.6 nM | ABQ | C24 H24 F N7 O2 | CC(C)n1cc(.... |
144 | 3NAX | - | MP7 | C28 H22 F2 N4 O4 | c1ccc(cc1).... |
145 | 3QCQ | ic50 = 0.158 uM | 3Q0 | C13 H15 N7 | CCNc1cc(nc.... |
146 | 4A06 | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
147 | 2R5T | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
148 | 2JDO | ic50 = 0.23 uM | I5S | C20 H22 Cl N3 O3 S | c1cc2cnccc.... |
149 | 1O6K | - | GLY ARG PRO ARG THR THR SER PHE ALA GLU | n/a | n/a |
150 | 3E88 | Ki = 2 nM | G96 | C24 H27 N7 O3 | CCn1c2cc(n.... |
151 | 2UW9 | - | GVP | C20 H20 Cl N3 | c1cc(ccc1c.... |
152 | 2JDR | ic50 = 0.5 nM | L20 | C24 H23 N5 O | Cc1c2cc(cc.... |
153 | 3D0E | ic50 = 13 nM | G93 | C21 H27 N7 O3 | CCn1c2c(cn.... |
154 | 3UBD | Kd = 2.9 uM | SL0 | C25 H24 O12 | CC1C(C(C(C.... |
155 | 4GUE | Kd = 5.8 uM | QCT | C21 H20 O11 | C[C@H]1[C@.... |
156 | 3G51 | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
157 | 4NUS | ic50 = 0.005 uM | 2NK | C22 H21 F2 N3 O | CN1CCN(CC1.... |
158 | 4NW6 | ic50 = 0.004 uM | 2NS | C23 H20 N4 O4 | COc1cc(cc(.... |
159 | 4NW5 | ic50 = 0.02 uM | 2NR | C23 H21 F N2 O5 | COc1cccc(c.... |
160 | 2W7X | ic50 = 24 nM | D1A | C18 H17 N7 O3 | [H]/N=C(N).... |
161 | 4A9U | - | A9U | C27 H28 N4 O2 | c1ccc(cc1).... |
162 | 2YCF | ic50 = 0.03 nM | YCF | C19 H24 N10 O3 | [H]/N=C(N/.... |
163 | 4BDI | ic50 = 227.7 uM | HAU | C14 H19 N3 O2 | Cc1ccc(nc1.... |
164 | 2YCR | ic50 = 69.6 nM | HCW | C23 H28 N10 O | C/C(=NNC1=.... |
165 | 2WTJ | ic50 = 0.7 uM | WTJ | C16 H20 N4 O3 S | CN(C)CCNC(.... |
166 | 4BDB | ic50 = 85.6 uM | ODO | C8 H9 N O3 | C/C(=NO)/c.... |
167 | 2YIT | ic50 = 0.29 nM | YIT | C21 H24 N6 O2 | CCC/C(=NNC.... |
168 | 2W0J | ic50 = 240 nM | ZAT | C19 H24 N10 O | [H]/N=C(N).... |
169 | 6CCY | ic50 = 0.003 uM | EX4 | C29 H33 F4 N7 O | C[C@@H]1CC.... |
170 | 3QKK | - | SMH | C28 H38 N2 O7 S | CCOCCN(C[C.... |
171 | 6NPZ | - | GLY ARG PRO ARG THR THR ZXW PHE ALA GLU | n/a | n/a |
172 | 4EKL | ic50 = 5 nM | 0RF | C24 H32 Cl N5 O2 | C[C@@H]1C[.... |
173 | 3CQW | ic50 = 42 nM | CQW | C12 H11 Cl N6 | c1c(c2c([n.... |
174 | 4GV1 | ic50 = 3 nM | 0XZ | C21 H25 Cl N6 O2 | c1cc(ccc1[.... |
175 | 3MVH | ic50 = 0.5 nM | WFE | C20 H22 F2 N6 O | CCc1c[nH]c.... |
176 | 3MV5 | ic50 = 180 nM | XFE | C11 H15 N5 | Cc1c[nH]c2.... |
177 | 3QKL | - | SMR | C29 H40 N4 O5 S | CCOCC[N@@].... |
178 | 5OTF | - | AQ5 | C20 H24 N6 | c1cnc2c(c1.... |
179 | 3TKU | ic50 = 1.92 uM | M77 | C14 H17 N3 O2 S | c1cc2cnccc.... |
180 | 3V8S | ic50 = 0.65 uM | 0HD | C16 H16 N4 O | c1ccc(cc1).... |
181 | 4OTH | ic50 = 9 nM | DRN | C25 H23 N5 O2 S | [H]/N=C(/N.... |
182 | 3A62 | - | STU | C28 H26 N4 O3 | C[C@@]12[C.... |
183 | 3WF9 | ic50 = 567 nM | FS7 | C24 H25 N3 O5 S | C[C@H]1CCc.... |
184 | 3WF8 | ic50 = 232 nM | F76 | C23 H23 N3 O5 S | c1ccc2c(c1.... |
185 | 4L3L | - | 5FI | C19 H21 F3 N6 | CCc1cncnc1.... |
186 | 3WE4 | ic50 = 15 nM | 5FI | C19 H21 F3 N6 | CCc1cncnc1.... |
187 | 3WF5 | ic50 = 81 nM | FZ8 | C17 H17 N7 | c1ccc2c(c1.... |
188 | 2F2U | - | M77 | C14 H17 N3 O2 S | c1cc2cnccc.... |
189 | 6C0T | ic50 = 43.1 nM | EE4 | C30 H30 F N5 O5 | CCCOc1ccc(.... |
190 | 6BXI | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
191 | 5F9E | ic50 = 0.46 nM | 5VS | C23 H21 N5 O2 | CC1(NC(=O).... |
192 | 1XJD | Ki = 0.33 nM | STU | C28 H26 N4 O3 | C[C@@]12[C.... |
193 | 3TXO | ic50 = 9 nM | 07U | C17 H19 N5 | CC(C)(CNc1.... |
194 | 1V0P | ic50 = 0.13 uM | PVB | C20 H25 Cl N6 O3 | CC(C)[C@H].... |
195 | 1V0O | ic50 = 5.5 uM | INR | C16 H10 N2 O5 S | c1ccc2c(c1.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | BAM | 1.0000 |
2 | NIO | 1.0000 |
3 | VGL | 1.0000 |
4 | BEZ | 1.0000 |
5 | UNU | 1.0000 |
6 | NCA | 1.0000 |
7 | PZA | 1.0000 |
8 | PBC | 1.0000 |
9 | AC0 | 1.0000 |
10 | NBZ | 1.0000 |
11 | 6PC | 1.0000 |
12 | BE7 | 1.0000 |
13 | BNS | 1.0000 |
14 | SS1 | 1.0000 |
15 | YCP | 1.0000 |
16 | QSC | 0.9954 |
17 | M58 | 0.9948 |
18 | FOA | 0.9911 |
19 | IT2 | 0.9906 |
20 | PYC | 0.9898 |
21 | C21 | 0.9894 |
22 | JZ7 | 0.9890 |
23 | TZC | 0.9881 |
24 | TP5 | 0.9870 |
25 | PRO | 0.9864 |
26 | SMV | 0.9861 |
27 | 265 | 0.9860 |
28 | JBN | 0.9858 |
29 | IND | 0.9820 |
30 | GAG | 0.9809 |
31 | LZ1 | 0.9806 |
32 | 273 | 0.9799 |
33 | PY7 | 0.9798 |
34 | SS2 | 0.9798 |
35 | FAN | 0.9796 |
36 | DEN | 0.9796 |
37 | 5AC | 0.9795 |
38 | PHB | 0.9793 |
39 | NPO | 0.9792 |
40 | BZI | 0.9782 |
41 | CFI | 0.9782 |
42 | 0R1 | 0.9769 |
43 | 4JP | 0.9765 |
44 | 2PC | 0.9763 |
45 | MPI | 0.9758 |
46 | RSO | 0.9758 |
47 | HBX | 0.9755 |
48 | JAB | 0.9755 |
49 | GVH | 0.9753 |
50 | BZF | 0.9749 |
51 | PYF | 0.9734 |
52 | 282 | 0.9733 |
53 | OXQ | 0.9732 |
54 | HBD | 0.9728 |
55 | QUZ | 0.9727 |
56 | 1Y6 | 0.9727 |
57 | 8GC | 0.9724 |
58 | BE2 | 0.9722 |
59 | BHO | 0.9719 |
60 | UGC | 0.9717 |
61 | NPY | 0.9717 |
62 | OAA | 0.9715 |
63 | Z82 | 0.9711 |
64 | SAL | 0.9705 |
65 | 1PT | 0.9699 |
66 | 3U4 | 0.9697 |
67 | NBE | 0.9694 |
68 | IDM | 0.9694 |
69 | GBD | 0.9692 |
70 | JBE | 0.9691 |
71 | ISZ | 0.9690 |
72 | 826 | 0.9687 |
73 | 54D | 0.9684 |
74 | NMJ | 0.9682 |
75 | ABN | 0.9681 |
76 | 4CS | 0.9679 |
77 | 2CK | 0.9676 |
78 | P72 | 0.9675 |
79 | ES6 | 0.9674 |
80 | 4SV | 0.9674 |
81 | SYN | 0.9674 |
82 | PAB | 0.9674 |
83 | PBZ | 0.9661 |
84 | JZ5 | 0.9660 |
85 | 3AB | 0.9660 |
86 | SW7 | 0.9658 |
87 | AMC | 0.9649 |
88 | AX7 | 0.9648 |
89 | 60P | 0.9644 |
90 | 1DU | 0.9643 |
91 | 4MA | 0.9639 |
92 | I1E | 0.9639 |
93 | MLT | 0.9639 |
94 | 270 | 0.9635 |
95 | J1Z | 0.9634 |
96 | 1MR | 0.9633 |
97 | 0CT | 0.9629 |
98 | GAB | 0.9626 |
99 | 3NT | 0.9625 |
100 | JKE | 0.9622 |
101 | HIO | 0.9620 |
102 | 3HB | 0.9620 |
103 | 53C | 0.9617 |
104 | OVV | 0.9611 |
105 | 0RW | 0.9608 |
106 | FEH | 0.9608 |
107 | HLR | 0.9606 |
108 | 2K4 | 0.9606 |
109 | MNN | 0.9604 |
110 | FPI | 0.9601 |
111 | OK7 | 0.9600 |
112 | ABV | 0.9598 |
113 | 1DJ | 0.9596 |
114 | NIZ | 0.9595 |
115 | BZX | 0.9594 |
116 | 2MI | 0.9594 |
117 | 6M9 | 0.9593 |
118 | 14O | 0.9591 |
119 | AC6 | 0.9591 |
120 | 5HN | 0.9586 |
121 | 3SK | 0.9584 |
122 | 7WV | 0.9582 |
123 | 5H1 | 0.9581 |
124 | 9EW | 0.9578 |
125 | DYA | 0.9576 |
126 | FBM | 0.9576 |
127 | 1WD | 0.9576 |
128 | SVN | 0.9573 |
129 | JZ9 | 0.9573 |
130 | F60 | 0.9568 |
131 | 174 | 0.9566 |
132 | FB2 | 0.9563 |
133 | MRZ | 0.9562 |
134 | 6M4 | 0.9560 |
135 | FQI | 0.9555 |
136 | TZL | 0.9555 |
137 | ZBT | 0.9555 |
138 | HY3 | 0.9554 |
139 | F05 | 0.9553 |
140 | WCE | 0.9551 |
141 | 5MB | 0.9550 |
142 | 6AI | 0.9547 |
143 | 14J | 0.9547 |
144 | TPA | 0.9541 |
145 | XM0 | 0.9540 |
146 | P92 | 0.9539 |
147 | UY7 | 0.9539 |
148 | 5MI | 0.9536 |
149 | BRT | 0.9534 |
150 | LMR | 0.9529 |
151 | ASP | 0.9522 |
152 | 3BZ | 0.9518 |
153 | PMB | 0.9516 |
154 | HBA | 0.9511 |
155 | COI | 0.9511 |
156 | HSM | 0.9510 |
157 | VNJ | 0.9500 |
158 | PCA | 0.9499 |
159 | HYP | 0.9492 |
160 | JAE | 0.9488 |
161 | M4T | 0.9485 |
162 | 3OC | 0.9485 |
163 | TFB | 0.9479 |
164 | PHU | 0.9478 |
165 | 9CL | 0.9476 |
166 | M6W | 0.9474 |
167 | F9P | 0.9472 |
168 | 3ID | 0.9470 |
169 | 2RH | 0.9470 |
170 | XBT | 0.9468 |
171 | TEO | 0.9464 |
172 | FBJ | 0.9459 |
173 | 7WG | 0.9459 |
174 | ES9 | 0.9452 |
175 | PRS | 0.9451 |
176 | MXN | 0.9451 |
177 | SPA | 0.9450 |
178 | CXF | 0.9441 |
179 | 1DQ | 0.9437 |
180 | 4P5 | 0.9437 |
181 | 11S | 0.9434 |
182 | RSF | 0.9434 |
183 | SRT | 0.9423 |
184 | ADE | 0.9421 |
185 | HY1 | 0.9420 |
186 | 1DV | 0.9419 |
187 | 4NC | 0.9419 |
188 | PZI | 0.9413 |
189 | NVI | 0.9412 |
190 | FCR | 0.9412 |
191 | PEA | 0.9411 |
192 | JB5 | 0.9409 |
193 | DMD | 0.9409 |
194 | TZE | 0.9406 |
195 | 3F0 | 0.9405 |
196 | 40E | 0.9403 |
197 | PAC | 0.9403 |
198 | PYJ | 0.9402 |
199 | NK | 0.9401 |
200 | 3M0 | 0.9396 |
201 | SHA | 0.9391 |
202 | DBH | 0.9391 |
203 | 1P3 | 0.9390 |
204 | QY9 | 0.9385 |
205 | XX2 | 0.9383 |
206 | NNO | 0.9383 |
207 | 4VP | 0.9383 |
208 | DHB | 0.9383 |
209 | MZ0 | 0.9379 |
210 | ISN | 0.9378 |
211 | K34 | 0.9377 |
212 | FE DB1 | 0.9373 |
213 | 2HO | 0.9373 |
214 | 3HA | 0.9373 |
215 | 2AQ | 0.9371 |
216 | 0TR | 0.9371 |
217 | ES5 | 0.9368 |
218 | INO | 0.9367 |
219 | 03V | 0.9367 |
220 | ASN | 0.9367 |
221 | H4N | 0.9365 |
222 | GJZ | 0.9365 |
223 | MZW | 0.9362 |
224 | TLA | 0.9361 |
225 | FK1 | 0.9361 |
226 | J9T | 0.9361 |
227 | L3Q | 0.9361 |
228 | SWD | 0.9359 |
229 | ES7 | 0.9358 |
230 | COU | 0.9357 |
231 | TSU | 0.9357 |
232 | KKN | 0.9356 |
233 | NXA | 0.9352 |
234 | FHB | 0.9351 |
235 | 2CQ | 0.9350 |
236 | P9P | 0.9348 |
237 | 5WV | 0.9346 |
238 | 3HM | 0.9340 |
239 | MYJ | 0.9339 |
240 | PEL | 0.9339 |
241 | 4JL | 0.9339 |
242 | TH0 | 0.9339 |
243 | FA0 | 0.9338 |
244 | APY | 0.9332 |
245 | 1SQ | 0.9331 |
246 | 93K | 0.9330 |
247 | QWN | 0.9330 |
248 | BP9 | 0.9329 |
249 | HPA | 0.9329 |
250 | 1WG | 0.9328 |
251 | KIV | 0.9327 |
252 | 2LP | 0.9326 |
253 | QSB | 0.9326 |
254 | 4A3 | 0.9325 |
255 | 10L | 0.9323 |
256 | RMN | 0.9322 |
257 | KYD | 0.9321 |
258 | 4FS | 0.9321 |
259 | 1MC | 0.9320 |
260 | 1LQ | 0.9319 |
261 | OCH | 0.9318 |
262 | 7N0 | 0.9318 |
263 | 7W4 | 0.9318 |
264 | 67N | 0.9318 |
265 | 4JM | 0.9316 |
266 | CEE | 0.9315 |
267 | MAK | 0.9314 |
268 | 9DA | 0.9312 |
269 | HSE | 0.9310 |
270 | PLQ | 0.9308 |
271 | R8A | 0.9308 |
272 | AHR | 0.9308 |
273 | JLZ | 0.9307 |
274 | 271 | 0.9306 |
275 | H42 | 0.9305 |
276 | SAN | 0.9302 |
277 | 1DW | 0.9302 |
278 | M1A | 0.9301 |
279 | 7HP | 0.9300 |
280 | TH7 | 0.9300 |
281 | RIB | 0.9299 |
282 | 51R | 0.9298 |
283 | BVG | 0.9298 |
284 | 150 | 0.9296 |
285 | SIN | 0.9293 |
286 | URF | 0.9292 |
287 | 5CU | 0.9291 |
288 | B24 | 0.9290 |
289 | WBU | 0.9286 |
290 | HDH | 0.9286 |
291 | FUM | 0.9284 |
292 | 9HX | 0.9283 |
293 | GYE | 0.9283 |
294 | CHB | 0.9283 |
295 | MAE | 0.9283 |
296 | XQ0 | 0.9282 |
297 | 2MH | 0.9282 |
298 | WOT | 0.9280 |
299 | DOB | 0.9280 |
300 | HX2 | 0.9280 |
301 | 3PF | 0.9280 |
302 | 4HO | 0.9279 |
303 | O72 | 0.9279 |
304 | 9X7 | 0.9279 |
305 | AAS | 0.9279 |
306 | 8OZ | 0.9279 |
307 | BP1 | 0.9278 |
308 | THE | 0.9278 |
309 | MCT | 0.9276 |
310 | HVQ | 0.9275 |
311 | 5NU | 0.9273 |
312 | 9TW | 0.9273 |
313 | PKU | 0.9271 |
314 | XCZ | 0.9270 |
315 | RBL | 0.9268 |
316 | 8NY | 0.9268 |
317 | FBV | 0.9268 |
318 | BHA | 0.9267 |
319 | 7MU | 0.9267 |
320 | N5J | 0.9267 |
321 | 1P7 | 0.9266 |
322 | PRI | 0.9266 |
323 | OHG | 0.9266 |
324 | DE5 | 0.9265 |
325 | FP1 | 0.9265 |
326 | JZ3 | 0.9264 |
327 | Q88 | 0.9260 |
328 | 24W | 0.9260 |
329 | 4JT | 0.9260 |
330 | EDG | 0.9259 |
331 | 4M0 | 0.9259 |
332 | 69O | 0.9258 |
333 | FPN | 0.9258 |
334 | HQE | 0.9258 |
335 | 4JU | 0.9258 |
336 | GRE | 0.9255 |
337 | 1AB | 0.9255 |
338 | QXW | 0.9254 |
339 | 6MP | 0.9254 |
340 | 5SG | 0.9251 |
341 | 7WA | 0.9251 |
342 | XYP | 0.9251 |
343 | IHB | 0.9250 |
344 | 7B4 | 0.9250 |
345 | DA1 | 0.9249 |
346 | RHU | 0.9249 |
347 | ES1 | 0.9248 |
348 | 7CZ | 0.9248 |
349 | 173 | 0.9245 |
350 | 1NP | 0.9245 |
351 | ES0 | 0.9243 |
352 | GUA | 0.9242 |
353 | 5RG | 0.9241 |
354 | HHA | 0.9241 |
355 | 5IQ | 0.9240 |
356 | 6M1 | 0.9240 |
357 | FBA | 0.9240 |
358 | ET2 | 0.9238 |
359 | 5Q0 | 0.9237 |
360 | PBE | 0.9237 |
361 | JPZ | 0.9237 |
362 | 45L | 0.9235 |
363 | FBS | 0.9232 |
364 | 4YS | 0.9232 |
365 | 45C | 0.9230 |
366 | 5B1 | 0.9229 |
367 | PCR | 0.9229 |
368 | SMN | 0.9229 |
369 | MWM | 0.9225 |
370 | 2AC | 0.9225 |
371 | HQY | 0.9225 |
372 | 9RW | 0.9225 |
373 | TDR | 0.9222 |
374 | 0R0 | 0.9222 |
375 | DPR | 0.9220 |
376 | CWM | 0.9219 |
377 | PM6 | 0.9218 |
378 | 4ZE | 0.9218 |
379 | 4WL | 0.9218 |
380 | 3SL | 0.9218 |
381 | 9TZ | 0.9217 |
382 | R2B | 0.9216 |
383 | 6F0 | 0.9216 |
384 | OTR | 0.9214 |
385 | AL0 | 0.9214 |
386 | AMS | 0.9212 |
387 | LG4 | 0.9212 |
388 | 4ZA | 0.9210 |
389 | 2ZV | 0.9209 |
390 | AC5 | 0.9208 |
391 | FBW | 0.9207 |
392 | KOJ | 0.9207 |
393 | A09 | 0.9207 |
394 | HMH | 0.9204 |
395 | 4J8 | 0.9202 |
396 | EKZ | 0.9202 |
397 | HCS | 0.9202 |
398 | FB1 | 0.9202 |
399 | 5QY | 0.9202 |
400 | H8N | 0.9196 |
401 | 36R | 0.9196 |
402 | MLI | 0.9196 |
403 | LDU | 0.9196 |
404 | JYD | 0.9194 |
405 | IMR | 0.9193 |
406 | OXZ | 0.9193 |
407 | BVC | 0.9192 |
408 | ADZ | 0.9191 |
409 | F4Z | 0.9190 |
410 | LXC | 0.9188 |
411 | THR | 0.9186 |
412 | DAS | 0.9185 |
413 | GTQ | 0.9185 |
414 | 6CS | 0.9185 |
415 | ALO | 0.9181 |
416 | 4XR | 0.9181 |
417 | 069 | 0.9178 |
418 | ICF | 0.9178 |
419 | IFP | 0.9176 |
420 | CLW | 0.9174 |
421 | MLA | 0.9174 |
422 | 5OB | 0.9173 |
423 | 717 | 0.9173 |
424 | ES4 | 0.9172 |
425 | PYD | 0.9171 |
426 | ICP | 0.9171 |
427 | TC7 | 0.9170 |
428 | URS | 0.9169 |
429 | 25R | 0.9169 |
430 | R1X | 0.9168 |
431 | 286 | 0.9168 |
432 | 280 | 0.9168 |
433 | G3E | 0.9167 |
434 | OXC | 0.9167 |
435 | A1U | 0.9165 |
436 | C5J | 0.9164 |
437 | 5MK | 0.9164 |
438 | SNE | 0.9163 |
439 | 1SA | 0.9163 |
440 | 5M0 | 0.9162 |
441 | 2MP | 0.9161 |
442 | 3DO | 0.9161 |
443 | XYD | 0.9160 |
444 | PXY | 0.9160 |
445 | FPY | 0.9160 |
446 | HSO | 0.9159 |
447 | 54G | 0.9158 |
448 | HIS | 0.9158 |
449 | DMG | 0.9158 |
450 | MLM | 0.9157 |
451 | 34A | 0.9156 |
452 | 261 | 0.9156 |
453 | 4XH | 0.9154 |
454 | 3ZQ | 0.9152 |
455 | BTE | 0.9151 |
456 | 4CL | 0.9151 |
457 | 258 | 0.9151 |
458 | 98J | 0.9150 |
459 | VAL | 0.9150 |
460 | BZ3 | 0.9149 |
461 | TAR | 0.9149 |
462 | FBB | 0.9148 |
463 | VGD | 0.9148 |
464 | MUC | 0.9147 |
465 | 4CH | 0.9145 |
466 | 5VM | 0.9144 |
467 | XBZ | 0.9143 |
468 | QOS | 0.9142 |
469 | ES2 | 0.9141 |
470 | ORO | 0.9141 |
471 | FYU | 0.9138 |
472 | URQ | 0.9137 |
473 | EQT | 0.9137 |
474 | 2D0 | 0.9135 |
475 | PIM | 0.9133 |
476 | SPV | 0.9132 |
477 | D48 | 0.9130 |
478 | 23A | 0.9128 |
479 | K2T | 0.9127 |
480 | PEQ | 0.9126 |
481 | 0V5 | 0.9126 |
482 | HT4 | 0.9124 |
483 | J5I | 0.9124 |
484 | MZG | 0.9123 |
485 | SE2 | 0.9122 |
486 | DHR | 0.9121 |
487 | 264 | 0.9119 |
488 | PEP | 0.9119 |
489 | BML | 0.9118 |
490 | 2YU | 0.9116 |
491 | GRO | 0.9113 |
492 | MRY | 0.9113 |
493 | NYL | 0.9112 |
494 | HH8 | 0.9112 |
495 | 2AL | 0.9112 |
496 | 5UC | 0.9111 |
497 | 51F | 0.9111 |
498 | 275 | 0.9110 |
499 | 1P8 | 0.9109 |
500 | ASC | 0.9109 |
501 | HX3 | 0.9109 |
502 | 5MH | 0.9109 |
503 | 4JJ | 0.9108 |
504 | GLU | 0.9108 |
505 | RB5 | 0.9107 |
506 | 5XC | 0.9106 |
507 | P2D | 0.9103 |
508 | BEW | 0.9103 |
509 | XIY | 0.9103 |
510 | LT2 | 0.9103 |
511 | 8K2 | 0.9102 |
512 | 23W | 0.9102 |
513 | I3A | 0.9098 |
514 | 12Q | 0.9098 |
515 | 5JC | 0.9096 |
516 | 278 | 0.9096 |
517 | X0V | 0.9095 |
518 | 1M2 | 0.9094 |
519 | JZ2 | 0.9093 |
520 | HAI | 0.9092 |
521 | BGC | 0.9091 |
522 | DS0 | 0.9090 |
523 | GXE | 0.9089 |
524 | URP | 0.9089 |
525 | 34D | 0.9088 |
526 | DTL | 0.9088 |
527 | AHB | 0.9087 |
528 | IP0 | 0.9086 |
529 | CYH | 0.9085 |
530 | C2B | 0.9084 |
531 | K5W | 0.9083 |
532 | AZF | 0.9082 |
533 | 4HS | 0.9080 |
534 | AGK | 0.9080 |
535 | JBH | 0.9078 |
536 | 4NM | 0.9077 |
537 | 1LN | 0.9077 |
538 | RM1 | 0.9076 |
539 | 2IM | 0.9076 |
540 | 3PY | 0.9075 |
541 | SX1 | 0.9075 |
542 | IPH | 0.9075 |
543 | 43M | 0.9074 |
544 | 9DG | 0.9074 |
545 | N4B | 0.9072 |
546 | 1LM | 0.9072 |
547 | NOJ | 0.9072 |
548 | AW5 | 0.9070 |
549 | CFP | 0.9069 |
550 | ZXD | 0.9069 |
551 | CRS | 0.9069 |
552 | AKG | 0.9068 |
553 | AEF | 0.9067 |
554 | TM7 | 0.9067 |
555 | MBN | 0.9067 |
556 | CAQ | 0.9066 |
557 | 27Y | 0.9065 |
558 | OXE | 0.9065 |
559 | GUN | 0.9064 |
560 | SSN | 0.9060 |
561 | 3FH | 0.9059 |
562 | LEU | 0.9058 |
563 | KUF | 0.9058 |
564 | 2BG | 0.9057 |
565 | Z6J | 0.9056 |
566 | IQ0 | 0.9056 |
567 | 2EZ | 0.9055 |
568 | AZA | 0.9054 |
569 | AAE | 0.9053 |
570 | 4FA | 0.9052 |
571 | BSX | 0.9051 |
572 | 2DR | 0.9050 |
573 | HH5 | 0.9050 |
574 | YRL | 0.9047 |
575 | 8CL | 0.9047 |
576 | GIF | 0.9047 |
577 | URA | 0.9044 |
578 | A2F | 0.9042 |
579 | IHG | 0.9041 |
580 | XUL | 0.9041 |
581 | JBK | 0.9040 |
582 | MWJ | 0.9040 |
583 | G3P | 0.9039 |
584 | R67 | 0.9039 |
585 | PRA | 0.9038 |
586 | 2KT | 0.9037 |
587 | I4B | 0.9037 |
588 | 7HQ | 0.9037 |
589 | TTO | 0.9036 |
590 | 3AP | 0.9036 |
591 | CXL | 0.9033 |
592 | 5QX | 0.9031 |
593 | ANN | 0.9031 |
594 | RCO | 0.9031 |
595 | BR9 | 0.9030 |
596 | OVM | 0.9030 |
597 | ECE | 0.9030 |
598 | 2HQ | 0.9029 |
599 | MR1 | 0.9029 |
600 | GOJ | 0.9029 |
601 | HHN | 0.9029 |
602 | V1L | 0.9028 |
603 | GDE | 0.9028 |
604 | G6D | 0.9028 |
605 | 25W | 0.9026 |
606 | 6GU | 0.9025 |
607 | TTL | 0.9025 |
608 | 2AP | 0.9024 |
609 | RBJ | 0.9024 |
610 | XAN | 0.9024 |
611 | IGA | 0.9024 |
612 | 7W1 | 0.9023 |
613 | A13 | 0.9022 |
614 | TLD | 0.9022 |
615 | L99 | 0.9022 |
616 | SYV | 0.9020 |
617 | JA8 | 0.9019 |
618 | 4JN | 0.9017 |
619 | PIY | 0.9017 |
620 | CWS | 0.9016 |
621 | GLY GLY | 0.9016 |
622 | 4AP | 0.9016 |
623 | 3XX | 0.9015 |
624 | H3M | 0.9014 |
625 | DFB | 0.9014 |
626 | XYL | 0.9010 |
627 | FLA | 0.9010 |
628 | 3MB | 0.9009 |
629 | 2AS | 0.9009 |
630 | PXL | 0.9008 |
631 | 0P6 | 0.9007 |
632 | D1X | 0.9007 |
633 | SN4 | 0.9005 |
634 | HQT | 0.9004 |
635 | JFJ | 0.9004 |
636 | 284 | 0.9004 |
637 | ITN | 0.9003 |
638 | 6AP | 0.9002 |
639 | CTL | 0.9002 |
640 | OHP | 0.9002 |
641 | GLC | 0.9002 |
642 | 4JO | 0.9001 |
643 | 86J | 0.8999 |
644 | DX4 | 0.8999 |
645 | 3CH | 0.8999 |
646 | C2A | 0.8998 |
647 | SKM | 0.8998 |
648 | SVD | 0.8997 |
649 | LER | 0.8994 |
650 | HVK | 0.8994 |
651 | HRZ | 0.8993 |
652 | LG3 | 0.8990 |
653 | QSH | 0.8990 |
654 | 1XN | 0.8989 |
655 | PAF | 0.8988 |
656 | M3H | 0.8988 |
657 | H95 | 0.8988 |
658 | JZ1 | 0.8987 |
659 | QMP | 0.8987 |
660 | XLS | 0.8986 |
661 | 97T | 0.8986 |
662 | 6RQ | 0.8985 |
663 | 9YL | 0.8985 |
664 | IFM | 0.8985 |
665 | TIU | 0.8984 |
666 | OVP | 0.8982 |
667 | XRG | 0.8981 |
668 | 4AA | 0.8981 |
669 | 259 | 0.8981 |
670 | KMT | 0.8979 |
671 | 24B | 0.8979 |
672 | 4FH | 0.8978 |
673 | DOR | 0.8978 |
674 | 2CH | 0.8977 |
675 | 2FY | 0.8977 |
676 | GZL | 0.8977 |
677 | 26D | 0.8976 |
678 | HPY | 0.8976 |
679 | 8CM | 0.8973 |
680 | F81 | 0.8973 |
681 | HC4 | 0.8972 |
682 | GZ3 | 0.8971 |
683 | 92K | 0.8971 |
684 | S76 | 0.8968 |
685 | HPS | 0.8967 |
686 | 93B | 0.8965 |
687 | HMU | 0.8964 |
688 | 2PG | 0.8963 |
689 | CYT | 0.8962 |
690 | DHK | 0.8961 |
691 | HDA | 0.8960 |
692 | FCA | 0.8959 |
693 | OW4 | 0.8958 |
694 | ARB | 0.8958 |
695 | A7W | 0.8958 |
696 | IUR | 0.8958 |
697 | LNR | 0.8957 |
698 | BVF | 0.8956 |
699 | EA1 | 0.8956 |
700 | CSS | 0.8955 |
701 | 141 | 0.8955 |
702 | BOA | 0.8954 |
703 | NEQ | 0.8954 |
704 | 1GP | 0.8952 |
705 | 290 | 0.8952 |
706 | 42A | 0.8951 |
707 | SKA | 0.8951 |
708 | FUL | 0.8951 |
709 | TYL | 0.8950 |
710 | 3AL | 0.8950 |
711 | PNZ | 0.8950 |
712 | 8H8 | 0.8949 |
713 | DHQ | 0.8949 |
714 | 40O | 0.8947 |
715 | XYS | 0.8945 |
716 | PPR | 0.8943 |
717 | 2CO | 0.8941 |
718 | IFL | 0.8940 |
719 | IDH | 0.8938 |
720 | YH7 | 0.8937 |
721 | CRN | 0.8936 |
722 | IOM | 0.8936 |
723 | L60 | 0.8936 |
724 | PIH | 0.8935 |
725 | HIU | 0.8935 |
726 | 9PO | 0.8934 |
727 | FBT | 0.8934 |
728 | DGJ | 0.8933 |
729 | LZM | 0.8931 |
730 | 32X | 0.8931 |
731 | AZG | 0.8931 |
732 | IOL | 0.8930 |
733 | 25T | 0.8929 |
734 | 3QM | 0.8929 |
735 | LGA | 0.8929 |
736 | MET | 0.8928 |
737 | 9TY | 0.8928 |
738 | DGY | 0.8926 |
739 | 2EC | 0.8925 |
740 | P3K | 0.8925 |
741 | 2FT | 0.8924 |
742 | ODO | 0.8924 |
743 | ABU | 0.8923 |
744 | KG7 | 0.8921 |
745 | A2Q | 0.8921 |
746 | NSP | 0.8921 |
747 | HGW | 0.8921 |
748 | 5GU | 0.8920 |
749 | KJH | 0.8919 |
750 | 3NY | 0.8919 |
751 | DIN | 0.8919 |
752 | ZZT | 0.8919 |
753 | 8WO | 0.8918 |
754 | 0HO | 0.8918 |
755 | IZC | 0.8917 |
756 | AZ8 | 0.8917 |
757 | LG5 | 0.8916 |
758 | KJU | 0.8915 |
759 | RNT | 0.8914 |
760 | BNF | 0.8913 |
761 | RUU | 0.8913 |
762 | JZ4 | 0.8912 |
763 | Q24 | 0.8911 |
764 | JZ0 | 0.8911 |
765 | MQN | 0.8910 |
766 | SC2 | 0.8909 |
767 | BCP | 0.8908 |
768 | 4SX | 0.8906 |
769 | BPN | 0.8906 |
770 | MS9 | 0.8906 |
771 | PRY | 0.8906 |
772 | T9G | 0.8906 |
773 | PGA | 0.8905 |
774 | SEP | 0.8905 |
775 | DUC | 0.8905 |
776 | 4MV | 0.8902 |
777 | IF7 | 0.8900 |
778 | K7M | 0.8900 |
779 | MRW | 0.8900 |
780 | YAN | 0.8899 |
781 | ASO | 0.8899 |
782 | 23J | 0.8897 |
783 | RNS | 0.8897 |
784 | LDP | 0.8897 |
785 | 47J | 0.8894 |
786 | URC | 0.8893 |
787 | 4HC | 0.8891 |
788 | T2C | 0.8890 |
789 | 4P0 | 0.8888 |
790 | 0CU | 0.8888 |
791 | 4JQ | 0.8887 |
792 | IV2 | 0.8886 |
793 | G2F | 0.8886 |
794 | 0W8 | 0.8884 |
795 | 0HN | 0.8883 |
796 | 9MG | 0.8882 |
797 | 24T | 0.8880 |
798 | 93Q | 0.8880 |
799 | 92Z | 0.8879 |
800 | E5X | 0.8879 |
801 | 3Z7 | 0.8877 |
802 | 8GF | 0.8876 |
803 | M3T | 0.8875 |
804 | MT0 | 0.8875 |
805 | 52C | 0.8875 |
806 | HEW | 0.8874 |
807 | E60 | 0.8873 |
808 | 82I | 0.8873 |
809 | FGZ | 0.8873 |
810 | GLL | 0.8873 |
811 | 4BZ | 0.8873 |
812 | 938 | 0.8872 |
813 | MWP | 0.8872 |
814 | PYG | 0.8871 |
815 | TMZ | 0.8871 |
816 | B57 | 0.8870 |
817 | E7Z | 0.8870 |
818 | FDB | 0.8870 |
819 | MZB | 0.8870 |
820 | 1AN | 0.8869 |
821 | ICC | 0.8868 |
822 | 1XM | 0.8868 |
823 | 5RN | 0.8867 |
824 | L89 | 0.8866 |
825 | 1DH | 0.8866 |
826 | MAN | 0.8866 |
827 | PAE | 0.8865 |
828 | R9S | 0.8865 |
829 | FOT | 0.8864 |
830 | FP2 | 0.8863 |
831 | IPB | 0.8863 |
832 | 3MC | 0.8862 |
833 | HGQ | 0.8862 |
834 | HYN | 0.8861 |
835 | JIF | 0.8861 |
836 | FUC | 0.8861 |
837 | 4ZC | 0.8861 |
838 | UNC | 0.8861 |
839 | CEJ | 0.8860 |
840 | 0TU | 0.8860 |
841 | DHS | 0.8859 |
842 | RIP | 0.8859 |
843 | KT7 | 0.8858 |
844 | NLE | 0.8858 |
845 | KTA | 0.8857 |
846 | 2AF | 0.8856 |
847 | NVA | 0.8855 |
848 | HHH | 0.8855 |
849 | 0MK | 0.8855 |
850 | 6NT | 0.8854 |
851 | AJ2 | 0.8854 |
852 | FUB | 0.8853 |
853 | C2U | 0.8853 |
854 | ORN | 0.8851 |
855 | 4XX | 0.8851 |
856 | APG | 0.8850 |
857 | HTS | 0.8849 |
858 | 3Z8 | 0.8848 |
859 | EDR | 0.8846 |
860 | Y8I | 0.8846 |
861 | F4E | 0.8846 |
862 | 2ZM | 0.8845 |
863 | M5K | 0.8844 |
864 | SD4 | 0.8844 |
865 | HQJ | 0.8844 |
866 | 263 | 0.8843 |
867 | 3WA | 0.8843 |
868 | 4YO | 0.8842 |
869 | 4Z4 | 0.8841 |
870 | 8LG | 0.8841 |
871 | LEA | 0.8841 |
872 | B3R | 0.8840 |
873 | 4H2 | 0.8838 |
874 | ABE | 0.8837 |
875 | F5B | 0.8837 |
876 | 3IT | 0.8835 |
877 | DIU | 0.8833 |
878 | 76X | 0.8831 |
879 | J9N | 0.8830 |
880 | KBB | 0.8830 |
881 | F31 | 0.8829 |
882 | SJ5 | 0.8828 |
883 | OGA | 0.8827 |
884 | VNL | 0.8827 |
885 | 285 | 0.8826 |
886 | RJY | 0.8824 |
887 | MEW | 0.8824 |
888 | Q6T | 0.8824 |
889 | L5V | 0.8823 |
890 | PBA | 0.8822 |
891 | NDH | 0.8821 |
892 | F9Y | 0.8820 |
893 | SWA | 0.8820 |
894 | HJP | 0.8819 |
895 | SER | 0.8819 |
896 | XIX | 0.8818 |
897 | CIZ | 0.8818 |
898 | DSN | 0.8817 |
899 | LCN | 0.8815 |
900 | EYK | 0.8815 |
901 | BTY | 0.8814 |
902 | DBX | 0.8812 |
903 | ABI | 0.8812 |
904 | MPD | 0.8810 |
905 | AQO | 0.8809 |
906 | CIG | 0.8806 |
907 | GG6 | 0.8804 |
908 | GIO | 0.8804 |
909 | PHE | 0.8801 |
910 | EXO | 0.8801 |
911 | PE0 | 0.8800 |
912 | DFU | 0.8800 |
913 | 6X8 | 0.8800 |
914 | MBD | 0.8800 |
915 | 13P | 0.8800 |
916 | RAM | 0.8800 |
917 | FBU | 0.8799 |
918 | GLN | 0.8798 |
919 | 0JD | 0.8796 |
920 | CYS | 0.8793 |
921 | TGX | 0.8791 |
922 | 2HU | 0.8790 |
923 | NCT | 0.8790 |
924 | 2A9 | 0.8789 |
925 | 3A9 | 0.8788 |
926 | B55 | 0.8786 |
927 | 8S0 | 0.8783 |
928 | AZ9 | 0.8783 |
929 | JBQ | 0.8782 |
930 | SYG | 0.8781 |
931 | 6NI | 0.8781 |
932 | PZM | 0.8781 |
933 | ABA | 0.8779 |
934 | A29 | 0.8778 |
935 | 5NI | 0.8778 |
936 | G4D | 0.8778 |
937 | BCU | 0.8777 |
938 | 64K | 0.8777 |
939 | PAH | 0.8776 |
940 | 4VY | 0.8776 |
941 | AKH | 0.8776 |
942 | YHO | 0.8776 |
943 | N2Z | 0.8775 |
944 | MNM | 0.8775 |
945 | R8V | 0.8774 |
946 | G3F | 0.8774 |
947 | HHQ | 0.8774 |
948 | XQG | 0.8773 |
949 | MJ2 | 0.8772 |
950 | XAZ | 0.8772 |
951 | X1S | 0.8771 |
952 | IPZ | 0.8770 |
953 | 7NI | 0.8770 |
954 | IPU | 0.8769 |
955 | ZZ3 | 0.8769 |
956 | CTS | 0.8768 |
957 | 75K | 0.8767 |
958 | S0H | 0.8767 |
959 | 3FA | 0.8766 |
960 | 5JQ | 0.8766 |
961 | 8TX | 0.8765 |
962 | DEE | 0.8764 |
963 | FFP | 0.8763 |
964 | GAL | 0.8763 |
965 | JAW | 0.8762 |
966 | GMN | 0.8762 |
967 | 8ZE | 0.8760 |
968 | FW5 | 0.8760 |
969 | 8WT | 0.8759 |
970 | IVA | 0.8759 |
971 | TMT | 0.8756 |
972 | FLM | 0.8756 |
973 | XXR | 0.8756 |
974 | 1F1 | 0.8755 |
975 | BEA | 0.8755 |
976 | RUY | 0.8754 |
977 | ARA | 0.8754 |
978 | FPK | 0.8753 |
979 | R8S | 0.8749 |
980 | ACH | 0.8748 |
981 | SAT | 0.8748 |
982 | NOY | 0.8746 |
983 | 2C9 | 0.8744 |
984 | CP | 0.8744 |
985 | M2H | 0.8743 |
986 | QWW | 0.8742 |
987 | GVG | 0.8741 |
988 | QX2 | 0.8740 |
989 | 7MH | 0.8739 |
990 | H76 | 0.8737 |
991 | 4HM | 0.8737 |
992 | FK8 | 0.8737 |
993 | M0W | 0.8734 |
994 | DQY | 0.8733 |
995 | ALL | 0.8732 |
996 | 42C | 0.8731 |
997 | 495 | 0.8731 |
998 | SAR | 0.8730 |
999 | M1E | 0.8730 |
1000 | 4XV | 0.8730 |
1001 | HLZ | 0.8725 |
1002 | 6OT | 0.8725 |
1003 | 8IG | 0.8724 |
1004 | SOE | 0.8723 |
1005 | 2MY | 0.8721 |
1006 | M6N | 0.8721 |
1007 | MED | 0.8720 |
1008 | MUA | 0.8720 |
1009 | 2HG | 0.8718 |
1010 | DRL | 0.8718 |
1011 | M2K | 0.8718 |
1012 | 5JL | 0.8717 |
1013 | IWT | 0.8716 |
1014 | J9W | 0.8713 |
1015 | DGN | 0.8711 |
1016 | ICO | 0.8711 |
1017 | MSR | 0.8711 |
1018 | 2F6 | 0.8710 |
1019 | YTB | 0.8710 |
1020 | 42J | 0.8709 |
1021 | FA1 | 0.8709 |
1022 | B53 | 0.8708 |
1023 | BZ2 | 0.8707 |
1024 | IJZ | 0.8707 |
1025 | LLQ | 0.8706 |
1026 | LGC | 0.8706 |
1027 | DXX | 0.8705 |
1028 | 0OC | 0.8705 |
1029 | GLA | 0.8699 |
1030 | AJV | 0.8690 |
1031 | 6TZ | 0.8687 |
1032 | HQD | 0.8686 |
1033 | 3CE | 0.8686 |
1034 | M0Q | 0.8685 |
1035 | HZQ | 0.8685 |
1036 | 4SD | 0.8685 |
1037 | 35C | 0.8684 |
1038 | GP9 | 0.8681 |
1039 | ADK | 0.8679 |
1040 | 3DM | 0.8677 |
1041 | V55 | 0.8676 |
1042 | 4M4 | 0.8675 |
1043 | 15E | 0.8675 |
1044 | MO8 | 0.8673 |
1045 | M1Q | 0.8672 |
1046 | 2H5 | 0.8671 |
1047 | 7VS | 0.8671 |
1048 | CPZ | 0.8670 |
1049 | GAF | 0.8670 |
1050 | SNU | 0.8667 |
1051 | 9FL | 0.8666 |
1052 | 3MH | 0.8666 |
1053 | GCS | 0.8665 |
1054 | CMS | 0.8664 |
1055 | F0J | 0.8659 |
1056 | DMJ | 0.8657 |
1057 | 2FG | 0.8656 |
1058 | DUB | 0.8656 |
1059 | PMF | 0.8655 |
1060 | 2CM | 0.8655 |
1061 | GOL | 0.8655 |
1062 | 192 | 0.8654 |
1063 | BUA | 0.8653 |
1064 | JXN | 0.8653 |
1065 | 9X6 | 0.8649 |
1066 | N2I | 0.8649 |
1067 | J9Q | 0.8648 |
1068 | 149 | 0.8648 |
1069 | T6C | 0.8648 |
1070 | ICB | 0.8647 |
1071 | OPE | 0.8647 |
1072 | GTR | 0.8646 |
1073 | GXY | 0.8644 |
1074 | PRZ | 0.8643 |
1075 | 0N7 | 0.8643 |
1076 | UFV | 0.8642 |
1077 | GXL | 0.8641 |
1078 | NK2 | 0.8640 |
1079 | TEP | 0.8638 |
1080 | EUG | 0.8638 |
1081 | 7VD | 0.8634 |
1082 | 4HP | 0.8632 |
1083 | LSA | 0.8627 |
1084 | 6MH | 0.8626 |
1085 | 2A7 | 0.8625 |
1086 | FUF | 0.8623 |
1087 | 5RO | 0.8622 |
1088 | 12M | 0.8620 |
1089 | WOO | 0.8619 |
1090 | 4XS | 0.8618 |
1091 | 39A | 0.8618 |
1092 | N3W | 0.8618 |
1093 | KJY | 0.8616 |
1094 | JF6 | 0.8612 |
1095 | M45 | 0.8612 |
1096 | TB6 | 0.8611 |
1097 | ESP | 0.8608 |
1098 | DIE | 0.8606 |
1099 | BXO | 0.8600 |
1100 | HXX | 0.8596 |
1101 | 0FO | 0.8592 |
1102 | TM4 | 0.8587 |
1103 | OMD | 0.8585 |
1104 | ADA | 0.8582 |
1105 | 6UA | 0.8581 |
1106 | TAG | 0.8580 |
1107 | 3RK | 0.8579 |
1108 | INS | 0.8578 |
1109 | MSE | 0.8577 |
1110 | 1XX | 0.8572 |
1111 | 9CA | 0.8572 |
1112 | AX2 | 0.8566 |
1113 | 37T | 0.8563 |
1114 | DGL | 0.8561 |
1115 | DTU | 0.8561 |
1116 | Q02 | 0.8559 |
1117 | 13X | 0.8557 |
1118 | MPV | 0.8551 |
1119 | MSF | 0.8551 |
1120 | 2AK | 0.8549 |
1121 | 1SP | 0.8549 |
1122 | 5AN | 0.8539 |
1123 | BR8 | 0.8532 |
1124 | 0F9 | 0.8524 |
1125 | 3AY | 0.8506 |
This union binding pocket(no: 1) in the query (biounit: 5izf.bio1) has 52 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 4OAV | ACP | 6.83761 |
2 | 4OAV | ACP | 6.83761 |
3 | 6AC9 | ANP | 8.54701 |
4 | 4OH4 | ANP | 14.4144 |
5 | 4OH4 | ANP | 14.4144 |
6 | 6JKM | ADP | 22.8739 |
7 | 4JR7 | GNP | 25.9259 |
8 | 3UIM | ANP | 27.6074 |
9 | 6FYL | 3NG | 27.9202 |
10 | 4H3P | ANP | 28.2051 |
11 | 4H3P | ANP | 28.2051 |
12 | 4UX9 | ANP | 29.9145 |
13 | 5Y86 | HRM | 29.9145 |
14 | 4UX9 | ANP | 29.9145 |
15 | 4UX9 | ANP | 29.9145 |
16 | 4UX9 | ANP | 29.9145 |
17 | 6P5S | 3NG | 30.1994 |
18 | 5ZTN | CUR | 30.4843 |
19 | 1U5R | ATP | 30.7443 |
20 | 6F3G | CJN | 30.8475 |
21 | 3ALN | ANP | 30.8869 |
22 | 5X8I | SQZ | 31.2139 |
23 | 5X8I | SQZ | 31.2139 |
24 | 6XX7 | ANP | 31.5789 |
25 | 6FYV | 3NG | 31.7507 |
26 | 3HMO | STU | 31.9066 |
27 | 3HMO | STU | 31.9066 |
28 | 5HVJ | ANP | 32.0635 |
29 | 6A1G | 9OL | 32.1937 |
30 | 6YA7 | ADP | 32.1937 |
31 | 6K0J | CQO | 32.4159 |
32 | 2JLD | AG1 | 33.0484 |
33 | 2JLD | AG1 | 33.0484 |
34 | 3PTG | 932 | 33.3333 |
35 | 4NM5 | ADP | 33.4302 |
36 | 4NM5 | ADP | 33.4302 |
37 | 6K3L | 3NG | 33.432 |
38 | 3PLS | ANP | 33.8926 |
39 | 6VRF | ADP | 34.4482 |
40 | 6VRF | ADP | 34.4482 |
41 | 1UNH | IXM | 35.9589 |
42 | 3O0G | 3O0 | 35.9589 |
43 | 1UNH | IXM | 35.9589 |
44 | 4YZN | 4K5 | 36.5854 |
45 | 2A19 | ANP | 36.6197 |
46 | 1JPA | ANP | 36.859 |
47 | 4CFU | 2WC | 36.9637 |
48 | 4CFU | 2WC | 36.9637 |
49 | 4BCQ | TJF | 37.2093 |
50 | 4BCM | T7Z | 37.2093 |
51 | 4BCM | T7Z | 37.2093 |
52 | 4BCQ | TJF | 37.2093 |
53 | 4BCN | T9N | 37.3333 |
54 | 4BCN | T9N | 37.3333 |
55 | 6GUE | FB8 | 37.4172 |
56 | 6GUE | FB8 | 37.4172 |
57 | 5UPK | ANP | 37.5723 |
58 | 2PVF | ACP | 37.7246 |
59 | 4X7Q | 3YR | 37.8205 |
60 | 4X7Q | 3YR | 37.8205 |
61 | 2YAB | AMP | 38.4615 |
62 | 2YAB | AMP | 38.4615 |
63 | 3BU5 | ATP | 38.5621 |
64 | 3DLS | ADP | 38.806 |
65 | 3DLS | ADP | 38.806 |
66 | 3DLS | ADP | 38.806 |
67 | 3DLS | ADP | 38.806 |
68 | 3DLS | ADP | 38.806 |
69 | 3DLS | ADP | 38.806 |
70 | 3DLS | ADP | 38.806 |
71 | 3DLS | ADP | 38.806 |
72 | 3DLS | ADP | 38.806 |
73 | 3DLS | ADP | 38.806 |
74 | 3DLS | ADP | 38.806 |
75 | 3DLS | ADP | 38.806 |
76 | 3GQI | ACP | 38.9571 |
77 | 1U59 | STU | 39.3728 |
78 | 5WNL | STU | 39.6947 |
79 | 5WNL | STU | 39.6947 |
80 | 4BFM | ANP | 40.4192 |
81 | 3KN5 | ANP | 40.6154 |
82 | 3KN5 | ANP | 40.6154 |
83 | 1BYG | STU | 43.1655 |
84 | 3SRV | S19 | 44.0433 |
85 | 3SRV | S19 | 44.0433 |
86 | 3CY2 | MB9 | 44.2675 |
87 | 4L9I | 8PR | 45.584 |
88 | 2YAK | OSV | 47.0175 |
89 | 6QAV | HVH | 47.5 |
90 | 6PJX | SGV | 47.8632 |
91 | 4WNK | 453 | 48.433 |