- Navigate
- Expand All | Collapse All
- Receptor | Ligand | View in 3D
- Family: 90% | 70% | 50% | site
- External Links
- |
- Download
- Structure Biounit | Ligand Information
- 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 4 families. | |||||
1 | 4OAL | - | 245 | C12 H10 Cl N3 O | c1ccc(cc1).... |
2 | 5HMR | ic50 = 35 uM | FDZ | C10 H7 F3 N4 O2 S | c1cc(cc(c1.... |
3 | 6YAP | ic50 = 0.37 uM | OHZ | C16 H14 Cl F3 N2 O3 | c1ccc(c(c1.... |
4 | 5HHZ | - | ZME | C10 H9 N5 | Cc1ccn(c1).... |
5 | 5HQX | ic50 = 120 uM | EDZ | C11 H12 N4 O2 S | c1ccc(c(c1.... |
6 | 6YAO | ic50 = 1.5 uM | OJ2 | C16 H15 F3 N2 O3 | c1ccc(c(c1.... |
7 | 4O95 | - | 245 | C12 H10 Cl N3 O | c1ccc(cc1).... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 4OAL | - | 245 | C12 H10 Cl N3 O | c1ccc(cc1).... |
2 | 5HMR | ic50 = 35 uM | FDZ | C10 H7 F3 N4 O2 S | c1cc(cc(c1.... |
3 | 6YAP | ic50 = 0.37 uM | OHZ | C16 H14 Cl F3 N2 O3 | c1ccc(c(c1.... |
4 | 5HHZ | - | ZME | C10 H9 N5 | Cc1ccn(c1).... |
5 | 5HQX | ic50 = 120 uM | EDZ | C11 H12 N4 O2 S | c1ccc(c(c1.... |
6 | 6YAO | ic50 = 1.5 uM | OJ2 | C16 H15 F3 N2 O3 | c1ccc(c(c1.... |
7 | 4O95 | - | 245 | C12 H10 Cl N3 O | c1ccc(cc1).... |
8 | 2Q4W | - | FAD | C27 H33 N9 O15 P2 | Cc1cc2c(cc.... |
9 | 1W1Q | - | ZIP | C10 H13 N5 | CC(=CCNc1c.... |
10 | 2QKN | ic50 = 18 uM | 245 | C12 H10 Cl N3 O | c1ccc(cc1).... |
11 | 2QPM | ic50 = 42 uM | 246 | C13 H12 Cl N3 O | c1ccc(cc1).... |
12 | 3KJM | ic50 = 1.5 uM | 245 | C12 H10 Cl N3 O | c1ccc(cc1).... |
13 | 1W1S | - | EMU | C12 H11 N5 | c1ccc(cc1).... |
14 | 1W1R | - | ZEA | C10 H13 N5 O | C/C(=CCNc1.... |
15 | 6YAQ | ic50 = 0.059 uM | OHZ | C16 H14 Cl F3 N2 O3 | c1ccc(c(c1.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | L43 | 0.9253 |
2 | R3S | 0.9216 |
3 | DN8 | 0.9182 |
4 | A1H | 0.9067 |
5 | KK7 | 0.9048 |
6 | F13 | 0.9020 |
7 | 785 | 0.9013 |
8 | 01I | 0.9003 |
9 | HCC | 0.8999 |
10 | P5W | 0.8991 |
11 | BMU | 0.8976 |
12 | 3DL | 0.8941 |
13 | UV4 | 0.8941 |
14 | S16 | 0.8924 |
15 | 1UR | 0.8921 |
16 | YL3 | 0.8909 |
17 | HHW | 0.8902 |
18 | BBP | 0.8893 |
19 | 3TI | 0.8893 |
20 | S1C | 0.8892 |
21 | LZ7 | 0.8890 |
22 | BZH | 0.8857 |
23 | 0J6 | 0.8857 |
24 | 55H | 0.8849 |
25 | GQZ | 0.8826 |
26 | 797 | 0.8804 |
27 | 1UT | 0.8802 |
28 | 68Q | 0.8791 |
29 | 3Q1 | 0.8788 |
30 | LU2 | 0.8781 |
31 | GA6 | 0.8779 |
32 | 245 | 0.8776 |
33 | 1V0 | 0.8763 |
34 | NZO | 0.8757 |
35 | LD9 | 0.8749 |
36 | EEY | 0.8743 |
37 | OJ2 | 0.8742 |
38 | 2WF | 0.8725 |
39 | Q92 | 0.8722 |
40 | 6FX | 0.8715 |
41 | FXX | 0.8708 |
42 | 3Q2 | 0.8699 |
43 | 6AE | 0.8693 |
44 | CK8 | 0.8682 |
45 | K4T | 0.8681 |
46 | MT6 | 0.8677 |
47 | 0RA | 0.8674 |
48 | AO | 0.8672 |
49 | E7E | 0.8665 |
50 | GVN | 0.8664 |
51 | 1E5 | 0.8664 |
52 | 4RG | 0.8662 |
53 | F5N | 0.8662 |
54 | 6B5 | 0.8658 |
55 | ML1 | 0.8655 |
56 | 3Q0 | 0.8653 |
57 | 6F3 | 0.8652 |
58 | 57U | 0.8643 |
59 | TVC | 0.8638 |
60 | 655 | 0.8638 |
61 | SAK | 0.8635 |
62 | UUL | 0.8631 |
63 | T34 | 0.8626 |
64 | 0FZ | 0.8625 |
65 | L7A | 0.8622 |
66 | T21 | 0.8619 |
67 | 2B2 | 0.8616 |
68 | C9G | 0.8613 |
69 | OHZ | 0.8612 |
70 | 6ZM | 0.8610 |
71 | C95 | 0.8606 |
72 | INR | 0.8601 |
73 | Y0R | 0.8587 |
74 | 9YD | 0.8580 |
75 | ENY | 0.8577 |
76 | 7G2 | 0.8568 |
77 | GRK | 0.8564 |
78 | 62D | 0.8532 |
79 | WOS | 0.8530 |
This union binding pocket(no: 1) in the query (biounit: 6yap.bio1) has 20 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |