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- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 14 families. | |||||
1 | 6QXU | ic50 = 7 nM | JKN | C17 H14 F2 N2 O2 | CC(C)(c1cc.... |
2 | 3UDD | - | 34M | C20 H19 N5 O3 S | Cc1nnc(n1c.... |
3 | 4W6E | ic50 < 0.003 uM | 3J5 | C27 H29 N5 O2 | Cc1cc(ncc1.... |
4 | 4MSK | ic50 = 0.063 uM | 2C8 | C25 H19 N5 O3 | c1ccc(cc1).... |
5 | 4OA7 | - | 2XS | C25 H19 N3 O3 | c1cc2cccnc.... |
6 | 4K4E | - | K4E | C22 H25 Cl N4 O3 | COc1ccc(cc.... |
7 | 4N4V | ic50 = 0.002 uM | 2GY | C26 H29 N5 O2 | CC1([C@@H].... |
8 | 5ECE | ic50 = 9 nM | 5N2 | C26 H22 N6 O2 | c1ccc2c(c1.... |
9 | 4TOR | - | IW8 | C25 H28 Br N3 O4 S | CCN(c1cccc.... |
10 | 3UH4 | ic50 = 0.011 uM | XAV | C14 H11 F3 N2 O S | c1cc(ccc1c.... |
11 | 4I9I | ic50 = 0.008 uM | 1DY | C25 H22 N4 O4 | COc1ccccc1.... |
12 | 4DVI | - | 2IW | C26 H21 N3 O3 | Cc1ccnc2c1.... |
13 | 4LI6 | - | 1XO | C23 H21 N3 O2 S | c1ccc(cc1).... |
14 | 4MSG | ic50 = 0.1 nM | 2C6 | C25 H25 N5 O3 S | c1ccc(cc1).... |
15 | 3UH2 | ic50 = 1 uM | P34 | C17 H17 N3 O2 | CN(C)CC(=O.... |
16 | 5EBT | - | 5N8 | C23 H17 F5 N6 O2 | C[C@H]1Cn2.... |
17 | 4MT9 | ic50 = 0.1 nM | 2D6 | C24 H24 N4 O3 S | c1ccc2c(c1.... |
18 | 4N4T | ic50 = 0.049 uM | 2GV | C26 H23 N5 O2 | CC1([C@@H].... |
19 | 4N3R | ic50 = 0.15 uM | 2GU | C26 H22 F N5 O2 | CC1(CC(=O).... |
20 | 4LI7 | - | 1XP | C23 H23 Cl F N3 O3 | COc1cc(c(c.... |
21 | 4KRS | ic50 = 0.299 uM | 1SX | C15 H18 N4 O S | CC(C)(C)c1.... |
22 | 4TOS | - | 355 | C33 H33 N5 O4 | CC1=CC=CC2.... |
23 | 4BUV | ic50 = 21 nM | 16I | C19 H13 N3 O2 S | c1ccc2c(c1.... |
24 | 4BJ9 | ic50 = 45 nM | UHB | C24 H27 N9 O6 | c1cc2c(c(c.... |
25 | 4BU3 | ic50 = 59 nM | F40 | C14 H10 N2 O | c1ccc(cc1).... |
26 | 3P0Q | - | NNL | C14 H14 Cl N5 | Cc1cc(c2nn.... |
27 | 4UFU | ic50 = 10 nM | 2ZI | C16 H11 F3 N2 O | Cc1cccc2c1.... |
28 | 4UVX | ic50 = 11 nM | H2W | C15 H9 Cl F N O | c1cc2c(c(c.... |
29 | 4UFY | ic50 = 7 nM | M3W | C16 H14 N2 O | Cc1ccc(cc1.... |
30 | 4BJC | ic50 = 14 nM | RPB | C19 H18 F N3 O | CNCc1ccc(c.... |
31 | 4UVZ | - | 5NN | C15 H12 N2 O | c1ccc(cc1).... |
32 | 5AEH | ic50 = 0.037 uM | 8IR | C25 H19 Cl N4 O3 | COc1ccc(cc.... |
33 | 4UVV | ic50 = 32 nM | W8L | C16 H12 Cl N O | Cc1cccc2c1.... |
34 | 5OWT | - | F37 | C18 H14 N4 O3 | C[C@@]1(C(.... |
35 | 4UHG | ic50 = 540 nM | SZ5 | C15 H12 N2 O | Cc1ccc(cc1.... |
36 | 4UVY | ic50 = 5.5 nM | SGW | C16 H12 Cl N O2 | COc1cccc2c.... |
37 | 5NUT | ic50 = 12 nM | 9A8 | C17 H16 N2 O2 | CC(C)Oc1cc.... |
38 | 4BU8 | ic50 = 28 nM | 27F | C15 H9 N3 O | c1ccc2c(c1.... |
39 | 4UVW | ic50 = 19 nM | NYJ | C17 H15 N O | Cc1cccc2c1.... |
40 | 5NOB | ic50 = 0.0063 uM | 92T | C24 H17 Cl N8 O | c1ccc(c(c1.... |
41 | 4BUX | ic50 = 34 nM | F35 | C18 H14 N4 O3 | c1ccc2c(c1.... |
42 | 4BJB | ic50 = 219 nM | P34 | C17 H17 N3 O2 | CN(C)CC(=O.... |
43 | 3P0N | - | BPU | C11 H7 Br N2 O | c1cc2n(c1).... |
44 | 3U9Y | - | 09L | C24 H23 F N4 O3 | c1ccc2c(c1.... |
45 | 5AL5 | ic50 = 71 nM | JL9 | C18 H23 N5 O | c1cnccc1CN.... |
46 | 4BUW | ic50 = 15 nM | F33 | C17 H13 N3 O3 | c1ccc2c(c1.... |
47 | 4UVT | - | G1O | C10 H10 N2 O | CC1=CNC(=O.... |
48 | 4BUE | ic50 = 71 nM | JQF | C19 H19 N3 O2 | CC(C)CC(=O.... |
49 | 5AL4 | ic50 = 300 nM | WLH | C13 H20 N4 O | CN1CCN(CC1.... |
50 | 4W5I | ic50 = 97 nM | 3GX | C15 H16 N2 O | CN1CCCC2=C.... |
51 | 4BUD | ic50 = 5 nM | 29F | C18 H18 N2 O | CC(C)(C)c1.... |
52 | 4BFP | - | SWY | C29 H23 N5 O3 S | COc1ccc(cc.... |
53 | 4UVU | ic50 = 1200 nM | U1T | C21 H22 N2 O | Cc1cccc2c1.... |
54 | 5AKW | ic50 = 410 nM | NKI | C14 H11 Cl N2 O | c1ccc2c(c1.... |
55 | 5AL2 | ic50 = 360 nM | O53 | C16 H17 N3 O | CC(C)c1ccc.... |
56 | 4BS4 | ic50 = 72 nM | A64 | C18 H16 O2 | CC(C)c1ccc.... |
57 | 5AL3 | ic50 = 11000 nM | TGW | C14 H11 Cl2 N3 O | CN1c2c(ccc.... |
58 | 4UVN | - | CDJ | C15 H11 Cl N2 O | c1cc2c(c(c.... |
59 | 4BUS | ic50 = 176 nM | 32F | C16 H12 N2 O4 | c1ccc2c(c1.... |
60 | 3KR8 | Kd = 8 nM | XAV | C14 H11 F3 N2 O S | c1cc(ccc1c.... |
61 | 4M7B | ic50 = 200 nM | 28C | C14 H15 N5 O | Cc1cc(c2nn.... |
62 | 5AL1 | ic50 = 53000 nM | GN5 | C17 H19 N3 O | CC(C)(C)c1.... |
63 | 4BUU | ic50 = 56 nM | F38 | C15 H13 N3 O3 S | c1ccc2c(c1.... |
64 | 4UVS | - | R4E | C14 H18 N2 O | CCCCCC1=Cc.... |
65 | 4BUY | ic50 = 5 nM | F37 | C18 H14 N4 O3 | C[C@@]1(C(.... |
66 | 4UVO | - | 5WW | C16 H14 N2 O2 | COc1ccc(cc.... |
67 | 4BU9 | ic50 = 9 nM | 08C | C15 H12 N2 O2 | COc1ccc(cc.... |
68 | 5OWS | - | KC8 | C18 H16 N4 O2 | C[C@@]1(CN.... |
69 | 3P0P | - | NNF | C15 H17 F N4 O | CC1=CC(=O).... |
70 | 4BU6 | ic50 = 73 nM | RGK | C14 H11 N3 O | c1ccc2c(c1.... |
71 | 3MHJ | - | M3F | C14 H9 F3 N2 O | Cc1cc(nc2c.... |
72 | 4UVL | - | 32X | C9 H8 N2 O | c1cc2c(c(c.... |
73 | 4BUF | ic50 = 38 nM | F36 | C16 H12 N2 O2 | CC(=O)c1cc.... |
74 | 5AKU | ic50 = 150 nM | 29F | C18 H18 N2 O | CC(C)(C)c1.... |
75 | 4BUA | ic50 = 35 nM | 91F | C15 H12 N2 O S | CSc1ccc(cc.... |
76 | 4BU5 | ic50 = 102 nM | 3F4 | C14 H10 N2 O2 | c1ccc2c(c1.... |
77 | 4UX4 | - | E9L | C16 H15 N2 O | Cc1ccc(cc1.... |
78 | 4BU7 | ic50 = 11 nM | 25F | C14 H9 Br N2 O | c1ccc2c(c1.... |
79 | 3U9H | - | NCA | C6 H6 N2 O | c1cc(cnc1).... |
80 | 3UA9 | - | IWR | C25 H19 N3 O3 | c1cc2cccnc.... |
81 | 4BUT | ic50 = 12 nM | 31F | C14 H11 N3 O3 S | c1ccc2c(c1.... |
82 | 4BUI | ic50 = 23 nM | W2E | C16 H12 N2 O3 | COC(=O)c1c.... |
83 | 4J1Z | - | 495 | C8 H5 Cl N2 O | c1ccc2c(c1.... |
84 | 4J22 | Kd = 0.018 uM | AJ7 | C23 H24 Cl N3 O3 | CC1=CC(=O).... |
85 | 4J3L | Kd = 0.016 uM | AJ5 | C20 H19 Cl N2 O3 | CC1=CC(=O).... |
86 | 3MHK | - | P4L | C12 H11 N3 O S | c1ccnc(c1).... |
87 | 4J3M | ic50 = 0.021 uM | AJ8 | C17 H12 Cl N O3 | CC1=CC(=O).... |
88 | 4IUE | Kd = 0.28 uM | AJ4 | C16 H12 F N O | CC1=CC(=O).... |
89 | 4J21 | Kd = 0.039 uM | AJ6 | C16 H13 Cl N2 O | CC1=CC(=O).... |
90 | 3W51 | ic50 = 12 uM | AJ2 | C10 H9 N O | Cc1cc(nc2c.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 9 families. | |||||
1 | 6QXU | ic50 = 7 nM | JKN | C17 H14 F2 N2 O2 | CC(C)(c1cc.... |
2 | 3UDD | - | 34M | C20 H19 N5 O3 S | Cc1nnc(n1c.... |
3 | 4W6E | ic50 < 0.003 uM | 3J5 | C27 H29 N5 O2 | Cc1cc(ncc1.... |
4 | 4MSK | ic50 = 0.063 uM | 2C8 | C25 H19 N5 O3 | c1ccc(cc1).... |
5 | 4OA7 | - | 2XS | C25 H19 N3 O3 | c1cc2cccnc.... |
6 | 4K4E | - | K4E | C22 H25 Cl N4 O3 | COc1ccc(cc.... |
7 | 4N4V | ic50 = 0.002 uM | 2GY | C26 H29 N5 O2 | CC1([C@@H].... |
8 | 5ECE | ic50 = 9 nM | 5N2 | C26 H22 N6 O2 | c1ccc2c(c1.... |
9 | 4TOR | - | IW8 | C25 H28 Br N3 O4 S | CCN(c1cccc.... |
10 | 3UH4 | ic50 = 0.011 uM | XAV | C14 H11 F3 N2 O S | c1cc(ccc1c.... |
11 | 4I9I | ic50 = 0.008 uM | 1DY | C25 H22 N4 O4 | COc1ccccc1.... |
12 | 4DVI | - | 2IW | C26 H21 N3 O3 | Cc1ccnc2c1.... |
13 | 4LI6 | - | 1XO | C23 H21 N3 O2 S | c1ccc(cc1).... |
14 | 4MSG | ic50 = 0.1 nM | 2C6 | C25 H25 N5 O3 S | c1ccc(cc1).... |
15 | 3UH2 | ic50 = 1 uM | P34 | C17 H17 N3 O2 | CN(C)CC(=O.... |
16 | 5EBT | - | 5N8 | C23 H17 F5 N6 O2 | C[C@H]1Cn2.... |
17 | 4MT9 | ic50 = 0.1 nM | 2D6 | C24 H24 N4 O3 S | c1ccc2c(c1.... |
18 | 4N4T | ic50 = 0.049 uM | 2GV | C26 H23 N5 O2 | CC1([C@@H].... |
19 | 4N3R | ic50 = 0.15 uM | 2GU | C26 H22 F N5 O2 | CC1(CC(=O).... |
20 | 4LI7 | - | 1XP | C23 H23 Cl F N3 O3 | COc1cc(c(c.... |
21 | 4KRS | ic50 = 0.299 uM | 1SX | C15 H18 N4 O S | CC(C)(C)c1.... |
22 | 4TOS | - | 355 | C33 H33 N5 O4 | CC1=CC=CC2.... |
23 | 4BUV | ic50 = 21 nM | 16I | C19 H13 N3 O2 S | c1ccc2c(c1.... |
24 | 4BJ9 | ic50 = 45 nM | UHB | C24 H27 N9 O6 | c1cc2c(c(c.... |
25 | 4BU3 | ic50 = 59 nM | F40 | C14 H10 N2 O | c1ccc(cc1).... |
26 | 3P0Q | - | NNL | C14 H14 Cl N5 | Cc1cc(c2nn.... |
27 | 4UFU | ic50 = 10 nM | 2ZI | C16 H11 F3 N2 O | Cc1cccc2c1.... |
28 | 4UVX | ic50 = 11 nM | H2W | C15 H9 Cl F N O | c1cc2c(c(c.... |
29 | 4UFY | ic50 = 7 nM | M3W | C16 H14 N2 O | Cc1ccc(cc1.... |
30 | 4BJC | ic50 = 14 nM | RPB | C19 H18 F N3 O | CNCc1ccc(c.... |
31 | 4UVZ | - | 5NN | C15 H12 N2 O | c1ccc(cc1).... |
32 | 5AEH | ic50 = 0.037 uM | 8IR | C25 H19 Cl N4 O3 | COc1ccc(cc.... |
33 | 4UVV | ic50 = 32 nM | W8L | C16 H12 Cl N O | Cc1cccc2c1.... |
34 | 5OWT | - | F37 | C18 H14 N4 O3 | C[C@@]1(C(.... |
35 | 4UHG | ic50 = 540 nM | SZ5 | C15 H12 N2 O | Cc1ccc(cc1.... |
36 | 4UVY | ic50 = 5.5 nM | SGW | C16 H12 Cl N O2 | COc1cccc2c.... |
37 | 5NUT | ic50 = 12 nM | 9A8 | C17 H16 N2 O2 | CC(C)Oc1cc.... |
38 | 4BU8 | ic50 = 28 nM | 27F | C15 H9 N3 O | c1ccc2c(c1.... |
39 | 4UVW | ic50 = 19 nM | NYJ | C17 H15 N O | Cc1cccc2c1.... |
40 | 5NOB | ic50 = 0.0063 uM | 92T | C24 H17 Cl N8 O | c1ccc(c(c1.... |
41 | 4BUX | ic50 = 34 nM | F35 | C18 H14 N4 O3 | c1ccc2c(c1.... |
42 | 4BJB | ic50 = 219 nM | P34 | C17 H17 N3 O2 | CN(C)CC(=O.... |
43 | 3P0N | - | BPU | C11 H7 Br N2 O | c1cc2n(c1).... |
44 | 3U9Y | - | 09L | C24 H23 F N4 O3 | c1ccc2c(c1.... |
45 | 5AL5 | ic50 = 71 nM | JL9 | C18 H23 N5 O | c1cnccc1CN.... |
46 | 4BUW | ic50 = 15 nM | F33 | C17 H13 N3 O3 | c1ccc2c(c1.... |
47 | 4UVT | - | G1O | C10 H10 N2 O | CC1=CNC(=O.... |
48 | 4BUE | ic50 = 71 nM | JQF | C19 H19 N3 O2 | CC(C)CC(=O.... |
49 | 5AL4 | ic50 = 300 nM | WLH | C13 H20 N4 O | CN1CCN(CC1.... |
50 | 4W5I | ic50 = 97 nM | 3GX | C15 H16 N2 O | CN1CCCC2=C.... |
51 | 4BUD | ic50 = 5 nM | 29F | C18 H18 N2 O | CC(C)(C)c1.... |
52 | 4BFP | - | SWY | C29 H23 N5 O3 S | COc1ccc(cc.... |
53 | 4UVU | ic50 = 1200 nM | U1T | C21 H22 N2 O | Cc1cccc2c1.... |
54 | 5AKW | ic50 = 410 nM | NKI | C14 H11 Cl N2 O | c1ccc2c(c1.... |
55 | 5AL2 | ic50 = 360 nM | O53 | C16 H17 N3 O | CC(C)c1ccc.... |
56 | 4BS4 | ic50 = 72 nM | A64 | C18 H16 O2 | CC(C)c1ccc.... |
57 | 5AL3 | ic50 = 11000 nM | TGW | C14 H11 Cl2 N3 O | CN1c2c(ccc.... |
58 | 4UVN | - | CDJ | C15 H11 Cl N2 O | c1cc2c(c(c.... |
59 | 4BUS | ic50 = 176 nM | 32F | C16 H12 N2 O4 | c1ccc2c(c1.... |
60 | 3KR8 | Kd = 8 nM | XAV | C14 H11 F3 N2 O S | c1cc(ccc1c.... |
61 | 4M7B | ic50 = 200 nM | 28C | C14 H15 N5 O | Cc1cc(c2nn.... |
62 | 5AL1 | ic50 = 53000 nM | GN5 | C17 H19 N3 O | CC(C)(C)c1.... |
63 | 4BUU | ic50 = 56 nM | F38 | C15 H13 N3 O3 S | c1ccc2c(c1.... |
64 | 4UVS | - | R4E | C14 H18 N2 O | CCCCCC1=Cc.... |
65 | 4BUY | ic50 = 5 nM | F37 | C18 H14 N4 O3 | C[C@@]1(C(.... |
66 | 4UVO | - | 5WW | C16 H14 N2 O2 | COc1ccc(cc.... |
67 | 4BU9 | ic50 = 9 nM | 08C | C15 H12 N2 O2 | COc1ccc(cc.... |
68 | 5OWS | - | KC8 | C18 H16 N4 O2 | C[C@@]1(CN.... |
69 | 3P0P | - | NNF | C15 H17 F N4 O | CC1=CC(=O).... |
70 | 4BU6 | ic50 = 73 nM | RGK | C14 H11 N3 O | c1ccc2c(c1.... |
71 | 3MHJ | - | M3F | C14 H9 F3 N2 O | Cc1cc(nc2c.... |
72 | 4UVL | - | 32X | C9 H8 N2 O | c1cc2c(c(c.... |
73 | 4BUF | ic50 = 38 nM | F36 | C16 H12 N2 O2 | CC(=O)c1cc.... |
74 | 5AKU | ic50 = 150 nM | 29F | C18 H18 N2 O | CC(C)(C)c1.... |
75 | 4BUA | ic50 = 35 nM | 91F | C15 H12 N2 O S | CSc1ccc(cc.... |
76 | 4BU5 | ic50 = 102 nM | 3F4 | C14 H10 N2 O2 | c1ccc2c(c1.... |
77 | 4UX4 | - | E9L | C16 H15 N2 O | Cc1ccc(cc1.... |
78 | 4BU7 | ic50 = 11 nM | 25F | C14 H9 Br N2 O | c1ccc2c(c1.... |
79 | 3U9H | - | NCA | C6 H6 N2 O | c1cc(cnc1).... |
80 | 3UA9 | - | IWR | C25 H19 N3 O3 | c1cc2cccnc.... |
81 | 4BUT | ic50 = 12 nM | 31F | C14 H11 N3 O3 S | c1ccc2c(c1.... |
82 | 4BUI | ic50 = 23 nM | W2E | C16 H12 N2 O3 | COC(=O)c1c.... |
83 | 3SE2 | - | LDR | C13 H9 N O | c1ccc2c(c1.... |
84 | 6FYM | - | EBB | C15 H14 N4 O S | Cc1ccc2c(c.... |
85 | 5V7T | ic50 = 610 nM | 91V | C27 H32 N6 O | c1ccc(cc1).... |
86 | 3SMJ | - | FDR | C10 H10 N2 O S | CC1=Nc2c(c.... |
87 | 4F1L | - | 0RY | C11 H10 N2 O4 | c1cc(cc(c1.... |
88 | 4J1Z | - | 495 | C8 H5 Cl N2 O | c1ccc2c(c1.... |
89 | 4J22 | Kd = 0.018 uM | AJ7 | C23 H24 Cl N3 O3 | CC1=CC(=O).... |
90 | 4J3L | Kd = 0.016 uM | AJ5 | C20 H19 Cl N2 O3 | CC1=CC(=O).... |
91 | 3MHK | - | P4L | C12 H11 N3 O S | c1ccnc(c1).... |
92 | 4J3M | ic50 = 0.021 uM | AJ8 | C17 H12 Cl N O3 | CC1=CC(=O).... |
93 | 4IUE | Kd = 0.28 uM | AJ4 | C16 H12 F N O | CC1=CC(=O).... |
94 | 4J21 | Kd = 0.039 uM | AJ6 | C16 H13 Cl N2 O | CC1=CC(=O).... |
95 | 3W51 | ic50 = 12 uM | AJ2 | C10 H9 N O | Cc1cc(nc2c.... |
96 | 6EK3 | - | OUL | C14 H12 N2 O3 | c1cc(ccc1C.... |
97 | 4F0E | - | 0RU | C14 H12 N4 O S | Cc1cccc2c1.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | M3F | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 5XL | 0.9349 |
2 | DT7 | 0.9255 |
3 | CX6 | 0.9223 |
4 | B61 | 0.9201 |
5 | IXM | 0.9193 |
6 | LFN | 0.9184 |
7 | FNT | 0.9161 |
8 | 9CE | 0.9145 |
9 | NRA | 0.9137 |
10 | RHN | 0.9133 |
11 | EST | 0.9126 |
12 | 8SK | 0.9124 |
13 | NYJ | 0.9107 |
14 | 9TF | 0.9095 |
15 | RGK | 0.9087 |
16 | EAE | 0.9080 |
17 | 0FR | 0.9074 |
18 | AQN | 0.9073 |
19 | 39Z | 0.9069 |
20 | 7A9 | 0.9067 |
21 | 1YL | 0.9065 |
22 | F40 | 0.9063 |
23 | ZSP | 0.9058 |
24 | 1WO | 0.9050 |
25 | QNM | 0.9029 |
26 | 0OK | 0.9026 |
27 | H4B | 0.9023 |
28 | CHQ | 0.9021 |
29 | OA4 | 0.9020 |
30 | B52 | 0.9019 |
31 | EQU | 0.9016 |
32 | LUM | 0.9015 |
33 | LOT | 0.9013 |
34 | 9OF | 0.9012 |
35 | ESR | 0.9012 |
36 | 6VW | 0.9010 |
37 | NKI | 0.9010 |
38 | WLH | 0.9002 |
39 | ADL | 0.9000 |
40 | 4ZF | 0.9000 |
41 | KLV | 0.8995 |
42 | BA5 | 0.8992 |
43 | 4AB | 0.8991 |
44 | 7AP | 0.8991 |
45 | 2AN | 0.8990 |
46 | BRY | 0.8989 |
47 | 2J1 | 0.8989 |
48 | S98 | 0.8987 |
49 | 20D | 0.8982 |
50 | 19E | 0.8981 |
51 | 7L4 | 0.8974 |
52 | RDT | 0.8973 |
53 | HBI | 0.8968 |
54 | AXX | 0.8966 |
55 | 537 | 0.8965 |
56 | 1V1 | 0.8954 |
57 | 1QV | 0.8953 |
58 | 1V3 | 0.8953 |
59 | BGU | 0.8950 |
60 | X0T | 0.8950 |
61 | DFL | 0.8943 |
62 | PK3 | 0.8941 |
63 | 2WU | 0.8939 |
64 | NDD | 0.8938 |
65 | AZN | 0.8938 |
66 | B2E | 0.8937 |
67 | A73 | 0.8935 |
68 | B56 | 0.8935 |
69 | 2GQ | 0.8932 |
70 | 17M | 0.8931 |
71 | 1V4 | 0.8930 |
72 | GEN | 0.8928 |
73 | BIO | 0.8926 |
74 | 18E | 0.8926 |
75 | E6Q | 0.8926 |
76 | A5Q | 0.8926 |
77 | JF8 | 0.8924 |
78 | Q0K | 0.8923 |
79 | J3Z | 0.8921 |
80 | X04 | 0.8921 |
81 | 8M5 | 0.8921 |
82 | 1EL | 0.8920 |
83 | S60 | 0.8919 |
84 | TXQ | 0.8919 |
85 | 3F4 | 0.8916 |
86 | 5XK | 0.8914 |
87 | ESZ | 0.8913 |
88 | 1FL | 0.8913 |
89 | ALR | 0.8912 |
90 | SZ5 | 0.8912 |
91 | NOM | 0.8908 |
92 | 6DQ | 0.8907 |
93 | Q9T | 0.8907 |
94 | PLP | 0.8904 |
95 | YE7 | 0.8904 |
96 | HRD | 0.8902 |
97 | NQ8 | 0.8898 |
98 | FLF | 0.8894 |
99 | 1DR | 0.8894 |
100 | P4L | 0.8887 |
101 | 25F | 0.8883 |
102 | 6TJ | 0.8882 |
103 | BHS | 0.8881 |
104 | 22T | 0.8880 |
105 | 5WT | 0.8880 |
106 | W8L | 0.8878 |
107 | 0J4 | 0.8877 |
108 | 5ER | 0.8876 |
109 | EMO | 0.8875 |
110 | 5NN | 0.8875 |
111 | CDJ | 0.8874 |
112 | D9Z | 0.8870 |
113 | 2JK | 0.8870 |
114 | AP6 | 0.8870 |
115 | NEO | 0.8867 |
116 | 2MQ | 0.8866 |
117 | AOM | 0.8864 |
118 | H2W | 0.8864 |
119 | AFT | 0.8862 |
120 | DX2 | 0.8862 |
121 | OTA | 0.8859 |
122 | AOX | 0.8859 |
123 | H2B | 0.8859 |
124 | CUE | 0.8855 |
125 | UQ1 | 0.8854 |
126 | B21 | 0.8854 |
127 | NPX | 0.8851 |
128 | TRU | 0.8850 |
129 | ITE | 0.8850 |
130 | OPA | 0.8849 |
131 | IDZ | 0.8848 |
132 | HRM | 0.8847 |
133 | AGI | 0.8845 |
134 | UAY | 0.8844 |
135 | 2K8 | 0.8844 |
136 | 3GX | 0.8842 |
137 | R18 | 0.8841 |
138 | DHT | 0.8839 |
139 | TES | 0.8838 |
140 | HNT | 0.8837 |
141 | IQZ | 0.8836 |
142 | 5SD | 0.8835 |
143 | 5V7 | 0.8834 |
144 | E1K | 0.8833 |
145 | DT9 | 0.8831 |
146 | 1V8 | 0.8830 |
147 | 3UG | 0.8826 |
148 | HFT | 0.8825 |
149 | COL | 0.8825 |
150 | DNQ | 0.8823 |
151 | JWS | 0.8823 |
152 | E2Q | 0.8819 |
153 | 5XM | 0.8815 |
154 | 3J8 | 0.8814 |
155 | DK1 | 0.8812 |
156 | JTA | 0.8810 |
157 | 1CE | 0.8810 |
158 | GNV | 0.8809 |
159 | N0Z | 0.8807 |
160 | BIH | 0.8807 |
161 | A63 | 0.8807 |
162 | ESL | 0.8806 |
163 | 0LA | 0.8806 |
164 | 3AK | 0.8805 |
165 | ECS | 0.8803 |
166 | VUP | 0.8803 |
167 | DX7 | 0.8803 |
168 | ADN | 0.8802 |
169 | M3W | 0.8800 |
170 | VT3 | 0.8798 |
171 | 5VU | 0.8797 |
172 | 26C | 0.8796 |
173 | AOI | 0.8793 |
174 | Z21 | 0.8792 |
175 | 21D | 0.8791 |
176 | PMP | 0.8789 |
177 | JY4 | 0.8787 |
178 | DXK | 0.8787 |
179 | SQM | 0.8778 |
180 | AH6 | 0.8776 |
181 | CG | 0.8776 |
182 | Q5M | 0.8773 |
183 | 08C | 0.8772 |
184 | G6P | 0.8772 |
185 | ASD | 0.8772 |
186 | 8Y7 | 0.8771 |
187 | E9L | 0.8769 |
188 | HHS | 0.8766 |
189 | SDN | 0.8765 |
190 | 3WF | 0.8765 |
191 | 57D | 0.8764 |
192 | 5TY | 0.8762 |
193 | OAL | 0.8758 |
194 | L3L | 0.8757 |
195 | 6QT | 0.8754 |
196 | NPS | 0.8752 |
197 | BFH | 0.8751 |
198 | 6BK | 0.8751 |
199 | II4 | 0.8750 |
200 | F5C | 0.8747 |
201 | H52 | 0.8746 |
202 | KY3 | 0.8745 |
203 | V1T | 0.8745 |
204 | XM5 | 0.8740 |
205 | UN9 | 0.8736 |
206 | B2L | 0.8732 |
207 | UXH | 0.8731 |
208 | 3D8 | 0.8730 |
209 | ZHA | 0.8730 |
210 | 9JT | 0.8730 |
211 | 2QU | 0.8728 |
212 | 9KZ | 0.8723 |
213 | PQQ | 0.8721 |
214 | 3WL | 0.8720 |
215 | REF | 0.8719 |
216 | Y0V | 0.8717 |
217 | WS7 | 0.8716 |
218 | K68 | 0.8714 |
219 | 0J5 | 0.8713 |
220 | NFL | 0.8712 |
221 | 92O | 0.8709 |
222 | CZ0 | 0.8707 |
223 | JRO | 0.8707 |
224 | BHM | 0.8700 |
225 | AUG | 0.8700 |
226 | YEX | 0.8692 |
227 | BG6 | 0.8691 |
228 | BPU | 0.8691 |
229 | 68A | 0.8690 |
230 | AON | 0.8690 |
231 | LU2 | 0.8688 |
232 | YZ9 | 0.8688 |
233 | CNI | 0.8686 |
234 | X2M | 0.8683 |
235 | CLI | 0.8681 |
236 | 5WW | 0.8678 |
237 | ANB | 0.8678 |
238 | M77 | 0.8677 |
239 | AVX | 0.8676 |
240 | O9Q | 0.8671 |
241 | TGW | 0.8670 |
242 | GW3 | 0.8670 |
243 | RVE | 0.8668 |
244 | K7H | 0.8666 |
245 | ZRL | 0.8664 |
246 | 4NR | 0.8664 |
247 | MBP | 0.8659 |
248 | 344 | 0.8658 |
249 | 3Y7 | 0.8658 |
250 | 5E1 | 0.8658 |
251 | DRG | 0.8655 |
252 | 27F | 0.8654 |
253 | JO5 | 0.8652 |
254 | 3Q0 | 0.8652 |
255 | AUE | 0.8651 |
256 | OCZ | 0.8651 |
257 | PIQ | 0.8646 |
258 | C4E | 0.8646 |
259 | LP8 | 0.8645 |
260 | NPL | 0.8645 |
261 | 3JC | 0.8645 |
262 | 96U | 0.8645 |
263 | LR2 | 0.8644 |
264 | WG8 | 0.8644 |
265 | AHQ | 0.8640 |
266 | EZL | 0.8635 |
267 | 4GU | 0.8634 |
268 | 1ZC | 0.8628 |
269 | 3WJ | 0.8628 |
270 | KMP | 0.8624 |
271 | N2M | 0.8623 |
272 | M83 | 0.8623 |
273 | SJK | 0.8622 |
274 | 91F | 0.8622 |
275 | O9T | 0.8619 |
276 | LI7 | 0.8619 |
277 | 0SY | 0.8617 |
278 | MFR | 0.8617 |
279 | JCZ | 0.8613 |
280 | X8I | 0.8612 |
281 | NAR | 0.8612 |
282 | 62D | 0.8611 |
283 | MR4 | 0.8610 |
284 | WV7 | 0.8609 |
285 | 2IP | 0.8609 |
286 | QUE | 0.8605 |
287 | ANC | 0.8604 |
288 | YE6 | 0.8604 |
289 | RSV | 0.8604 |
290 | TCR | 0.8603 |
291 | 8MO | 0.8599 |
292 | GNJ | 0.8599 |
293 | 1UZ | 0.8598 |
294 | LVE | 0.8597 |
295 | CC6 | 0.8595 |
296 | JOH | 0.8594 |
297 | 4AU | 0.8593 |
298 | 2QV | 0.8592 |
299 | FSE | 0.8590 |
300 | 465 | 0.8589 |
301 | 5OR | 0.8588 |
302 | LR8 | 0.8585 |
303 | 6QF | 0.8584 |
304 | BGC BGC | 0.8584 |
305 | ZRK | 0.8578 |
306 | GNY | 0.8571 |
307 | 0UL | 0.8569 |
308 | 64F | 0.8569 |
309 | K25 | 0.8568 |
310 | EI1 | 0.8568 |
311 | B2X | 0.8567 |
312 | TK4 | 0.8567 |
313 | EES | 0.8563 |
314 | NIF | 0.8561 |
315 | 6ZW | 0.8551 |
316 | 338 | 0.8551 |
317 | 0DF | 0.8545 |
318 | JP2 | 0.8543 |
319 | 6WL | 0.8543 |
320 | LIG | 0.8538 |
321 | NAG | 0.8536 |
322 | PRL | 0.8533 |
323 | 1TJ | 0.8532 |
324 | PH2 | 0.8527 |
325 | 6FB | 0.8517 |
326 | P1J | 0.8511 |
This union binding pocket(no: 1) in the query (biounit: 4buy.bio1) has 30 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 6W65 | T9D | 7.5 |
This union binding pocket(no: 2) in the query (biounit: 4buy.bio2) has 30 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 1XK9 | P34 | None |
2 | 6W65 | T9D | 7.5 |