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No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 101 families. | |||||
1 | 4EQU | - | G6I | C30 H24 F3 N7 O2 | Cc1ccc(cc1.... |
2 | 2J7T | - | 274 | C28 H30 Cl N5 O4 S | Cc1c([nH]c.... |
3 | 4USF | - | 6UI | C19 H15 N3 O | COc1ccc2cc.... |
4 | 2J51 | - | DKI | C15 H13 F2 N7 O2 S2 | c1cc(c(c(c.... |
5 | 2UV2 | - | GVD | C22 H19 N7 | c1ccc2c(c1.... |
6 | 2JFL | - | DKI | C15 H13 F2 N7 O2 S2 | c1cc(c(c(c.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 70 families. | |||||
1 | 6NFY | Kd = 16 nM | B49 | C22 H27 F N4 O2 | CCN(CC)CCN.... |
2 | 6CQD | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
3 | 6CQF | ic50 = 0.0045 uM | F97 | C21 H26 F2 N8 | CC(C)n1c2c.... |
4 | 4APP | Ki = 0.064 uM | N53 | C33 H36 N6 O3 | CC1(c2c(c(.... |
5 | 5VEE | ic50 = 779 nM | 981 | C25 H23 Cl2 F N6 O | CCN1c2c(cn.... |
6 | 4O0X | Ki = 0.068 uM | 2OQ | C19 H20 N6 O | Cc1nc2ccc(.... |
7 | 6WLY | - | ARG LYS LYS ARG TYR THR VAL VAL GLY ASN | n/a | n/a |
8 | 4O0Y | Ki = 0.06 uM | 2OO | C17 H19 N7 O | CCNc1nc2cc.... |
9 | 4QMP | ic50 = 0.014 uM | DKI | C15 H13 F2 N7 O2 S2 | c1cc(c(c(c.... |
10 | 4U8Z | - | 3FE | C17 H15 N5 O | c1cc(cc(c1.... |
11 | 4QMX | ic50 = 11 uM | H8H | C27 H32 Cl N5 O5 | CN1CCN(CC1.... |
12 | 4QMT | ic50 = 0.01 uM | H1N | C29 H32 N4 O3 S | CCS(=O)(=O.... |
13 | 4QMM | ic50 = 0.46 uM | 35R | C19 H23 N7 O2 | c1cc2c(cc1.... |
14 | 4QMU | ic50 = 1.3 uM | SKE | C15 H12 F2 N6 O3 S | c1cc(c(c(c.... |
15 | 4W8E | - | 3JB | C20 H17 N7 O2 | Cc1nc(no1).... |
16 | 4QMZ | ic50 = 0.21 uM | B49 | C22 H27 F N4 O2 | CCN(CC)CCN.... |
17 | 1U5R | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
18 | 6YG5 | - | IHH | C22 H19 N7 | c1ccc2c(c1.... |
19 | 6YZ4 | - | 1E8 | C25 H24 N6 O2 | C=CC(=O)N1.... |
20 | 6YG4 | - | SU9 | C13 H11 N3 O2 | COc1ccc2c(.... |
21 | 5DH3 | ic50 = 38.1 nM | 5BS | C17 H16 N6 O3 S2 | CN1c2ccsc2.... |
22 | 4O0R | Ki = 0.036 uM | 7KC | C25 H30 N8 O S | Cc1nc2ccsc.... |
23 | 3FY0 | ic50 = 1090 nM | DW1 | C23 H13 N3 O4 Ru | C1=CC(C=C1.... |
24 | 3ALN | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
25 | 4EQU | - | G6I | C30 H24 F3 N7 O2 | Cc1ccc(cc1.... |
26 | 4OBQ | ic50 = 0.065 uM | 2QT | C20 H20 F N5 O | c1cc2c(cc1.... |
27 | 4U43 | Kd = 48 uM | 3D8 | C11 H9 N5 | c1cc(cnc1).... |
28 | 4OBP | ic50 = 0.017 uM | 2QU | C12 H8 F N5 | c1cc(nc2c1.... |
29 | 3ZLY | ic50 = 300 uM | YSO | C8 H6 N4 | c1cc(c2c(c.... |
30 | 3ZLS | ic50 = 39.4 uM | 92P | C9 H8 N2 O2 | COC(=O)c1c.... |
31 | 3ZLW | ic50 = 198 uM | MT8 | C13 H15 N O2 | C[C@]1(CCN.... |
32 | 3ZLX | ic50 = 157 uM | 5EZ | C14 H15 Cl N2 O2 | c1c2c(cc(c.... |
33 | 1S9J | - | BBM | C16 H13 Br F3 I N2 O4 | c1cc(c(cc1.... |
34 | 3EQH | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
35 | 3E8N | ic50 = 19 nM | VRA | C19 H20 F3 I N2 O5 S | COc1cc(c(c.... |
36 | 3EQG | - | ADP | C10 H15 N5 O10 P2 | c1nc(c2c(n.... |
37 | 3ZM4 | ic50 = 1.1 uM | 22T | C13 H13 Cl N2 O2 | c1c2c(cc(c.... |
38 | 3DV3 | - | MEK | C18 H18 F3 I N2 O5 | c1cc(c(cc1.... |
39 | 5DBX | - | ANP | C10 H17 N6 O12 P3 | c1nc(c2c(n.... |
40 | 4USF | - | 6UI | C19 H15 N3 O | COc1ccc2cc.... |
41 | 2J51 | - | DKI | C15 H13 F2 N7 O2 S2 | c1cc(c(c(c.... |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | FPX | 0.9097 |
This union binding pocket(no: 2) in the query (biounit: 2j7t.bio1) has 30 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |