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- PDB : .ZIP | .CSV
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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 1 families. | |||||
1 | 1E81 | - | M91 | C34 H49 N5 O6 S | CSC[C@@H](.... |
2 | 4ZEA | - | IMI | C10 H17 N3 O2 S | C1[C@H]2[C.... |
3 | 3ER3 | Ki = 81 nM | 0EL | C51 H78 N8 O9 | NULL |
4 | 4Y4D | - | CFF | C8 H10 N4 O2 | Cn1cnc2c1C.... |
5 | 5LWT | - | 7B3 | C10 H13 N3 O | Cc1c2cnnc(.... |
6 | 1EPM | - | THR PHE GLN ALA PSA LEU ARG GLU | n/a | n/a |
7 | 1EED | Ki = 16.2 uM | 0EO | C34 H55 N3 O8 | CC(C)C[C@@.... |
8 | 3PMY | - | 41L | C15 H13 N3 O | c1ccc(cc1).... |
9 | 1OEX | - | BOC HIS PRO PHE ALA LOV ILE HIS | n/a | n/a |
10 | 4ER4 | Ki = 160 nM | PRO HIS PRO PHE HIS LAV ILE HIS LYS | n/a | n/a |
11 | 4LBT | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
12 | 3PWW | - | ROC | C38 H50 N6 O5 | CC(C)(C)NC.... |
13 | 4Y38 | Kd = 4 mM | 0A9 | C10 H13 N O2 | COC(=O)[C@.... |
14 | 2JJJ | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
15 | 1GVV | - | 0GM | C51 H61 N5 O6 | CC(C)C[C@H.... |
16 | 3PMU | - | F7L | C14 H20 F N O2 | c1ccc(c(c1.... |
17 | 5OJE | Ki = 6.1 uM | VSK | C22 H27 N3 O | Cc1cc(c(c(.... |
18 | 1GVT | - | 2ZS | C31 H48 N4 O7 S | CC(C)OC(=O.... |
19 | 1EPR | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
20 | 5MB5 | - | 46P | C8 H10 N4 S | Cc1c(sc(n1.... |
21 | 5MB7 | - | 4AV | C8 H9 Cl N2 O2 | CNCc1cc(cc.... |
22 | 4Y4G | - | GGB | C5 H12 N4 O3 | [H]/N=C(N).... |
23 | 3ER5 | Ki = 1 nM | PRO HIS PRO PHE HIS STA VAL ILE HIS LYS | n/a | n/a |
24 | 3URL | - | HIS SER LEU PHE HIS PUK THR PRO | n/a | n/a |
25 | 3PCZ | - | BAM | C7 H9 N2 | c1ccc(cc1).... |
26 | 2V00 | Kd = 0.22 mM | V15 | C12 H13 N3 O | c1ccc(cc1).... |
27 | 5LWR | - | 7B2 | C27 H29 Cl N9 O | Cc1c2cnn3c.... |
28 | 3PLL | - | F06 | C8 H9 Cl N2 S | [H]/N=C(N).... |
29 | 4ER2 | Ki = 0.5 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
30 | 4LP9 | ic50 = 0.62 uM | SER LEU PHE HIS 22G THR PRO | n/a | n/a |
31 | 3PRS | - | RIT | C37 H48 N6 O5 S2 | CC(C)c1nc(.... |
32 | 1ENT | Ki = 110 nM | 0EM | C32 H52 N6 O7 P | NULL |
33 | 1E80 | - | 0GQ | C41 H64 N10 O6 | CC[C@H](C).... |
34 | 5LWS | - | 7B2 | C27 H29 Cl N9 O | Cc1c2cnn3c.... |
35 | 3PBD | - | F05 | C8 H8 N2 | c1ccc2c(c1.... |
36 | 1OD1 | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
37 | 3WZ6 | Ki = 1.1 uM | IXZ | C27 H25 N3 O2 S | c1ccc(cc1).... |
38 | 5ER1 | Ki = 960 nM | 0HT | C28 H48 N4 O5 | CC[C@H](C).... |
39 | 1OEW | - | SER THR | n/a | n/a |
40 | 1EPQ | Ki = 6.5 nM | 0QF | C31 H52 N4 O7 S2 | CCS[C@@H](.... |
41 | 5MB3 | - | 5GL | C13 H20 N2 O S | CCCN1C2=C(.... |
42 | 2JJI | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
43 | 3PCW | - | FBF | C8 H7 F3 N2 | [H]/N=C(/c.... |
44 | 3PGI | - | F41 | C14 H18 N2 O3 | c1cc2c(cc1.... |
45 | 4Y3J | Kd = 6.8 mM | HIC | C7 H11 N3 O2 | Cn1cc(nc1).... |
46 | 1GVW | Ki = 110 nM | 0EM | C32 H52 N6 O7 P | NULL |
47 | 5ER2 | Ki = 0.27 uM | 0EK | C50 H77 N9 O9 | NULL |
48 | 1EPP | Ki = 69 nM | 1Z1 | C32 H57 N7 O6 S2 | CC[C@H](C).... |
49 | 2ER7 | ic50 = 0.7 nM | BOC HIS PRO PHE HIS LOV ILE HIS | n/a | n/a |
50 | 4KUP | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
51 | 3WZ7 | Ki = 1.8 uM | IXY | C28 H30 N4 O2 S | c1ccc(cc1).... |
52 | 1EPO | Ki = 11 nM | 2Z3 | C32 H49 F2 N5 O7 | NULL |
53 | 1ER8 | - | DHI PRO PHE HIS LEU LEU VAL TYR | n/a | n/a |
54 | 3WZ8 | Ki = 1.5 uM | IXV | C27 H25 N3 O2 S | c1ccc(cc1).... |
55 | 3PI0 | - | F91 | C14 H14 N2 O2 | c1cc2c(cc1.... |
56 | 1GVU | Ki = 1 nM | PRO HIS PRO PHE HIS STA VAL ILE HIS LYS | n/a | n/a |
57 | 1EPL | - | PRO LEU GLU PSA ARG LEU | n/a | n/a |
58 | 4Y3Y | Kd = 4.5 mM | DCL | C6 H15 N O | CC(C)C[C@@.... |
59 | 1E5O | - | 3AI | C23 H38 N4 O4 S | CC[C@H](C).... |
60 | 3PLD | - | F90 | C8 H9 Cl N2 S | [H]/N=C(N).... |
61 | 5MB0 | Kd = 1.4 mM | F91 | C14 H14 N2 O2 | c1cc2c(cc1.... |
62 | 2ER6 | Ki = 60 nM | PRO THR GLU PUK ARG GLU | n/a | n/a |
63 | 3URI | - | HIS PRO HIS LEU SER 13E ALA HIS | n/a | n/a |
64 | 4LHH | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
65 | 4Y48 | - | GLY PRO | n/a | n/a |
66 | 1E82 | - | M90 | C34 H49 N5 O6 S | CSC[C@@H](.... |
67 | 1EPN | - | 2ZS | C31 H48 N4 O7 S | CC(C)OC(=O.... |
68 | 2ER9 | Ki = 40 nM | BOC HIS PRO PHE HIS STA LEU PHE | n/a | n/a |
69 | 4Y4J | Kd = 3.4 mM | LNR | C8 H11 N O3 | c1cc(c(cc1.... |
70 | 1GVX | Ki = 60 nM | PRO THR GLU PUK ARG GLU | n/a | n/a |
71 | 3PM4 | - | F5N | C15 H13 N3 O | c1ccc(cc1).... |
72 | 3PB5 | - | F63 | C11 H12 N2 O2 | CNCc1ccc(o.... |
73 | 4ZE6 | Kd = 3.3 mM | 011 | C7 H15 N O2 | C(CCCN)CCC.... |
74 | 3PBZ | - | F02 | C11 H17 N3 O | CCN(CC)c1c.... |
75 | 4ER1 | Ki = 0.24 uM | 0ZP | C51 H68 N5 O4 | CC[C@H](C).... |
76 | 5RBV | - | RQD | C10 H12 F N O2 | COC(=O)[C@.... |
77 | 5RCG | - | REG | C11 H20 N2 O2 | C1CCC(C1)N.... |
78 | 5R1U | - | T9G | C9 H13 N O | CC[C@H](c1.... |
79 | 5RC3 | - | RAY | C11 H14 F N O3 | COCCOCC(=O.... |
80 | 5R21 | - | R9Y | C11 H16 N2 | CN1CCCc2c1.... |
81 | 5RCE | - | RE4 | C11 H13 N5 | Cc1cc(nc(n.... |
82 | 5RBS | - | R8V | C9 H9 N O2 | CN1[C@H](c.... |
83 | 5RBU | - | R97 | C10 H10 N2 S | Cc1csc(n1).... |
84 | 5R2C | - | RE4 | C11 H13 N5 | Cc1cc(nc(n.... |
85 | 5R20 | - | R9V | C14 H19 N O | c1ccc(cc1).... |
86 | 5RCC | - | RDV | C12 H22 N2 O | C1CCC(C1)C.... |
87 | 5RC4 | - | RB7 | C11 H16 Br N O2 S | Cc1cc(ccc1.... |
88 | 5R25 | - | RBJ | C8 H11 N O | CNCc1ccc(c.... |
89 | 5HCT | Ki = 0.0254 uM | 61P | C30 H30 N8 O2 | c1ccc2c(c1.... |
90 | 5R1W | - | R8Y | C10 H13 N O3 S | CCN(CCC(=O.... |
91 | 5R23 | - | RAY | C11 H14 F N O3 | COCCOCC(=O.... |
92 | 5RC5 | - | RBG | C10 H20 N2 O | CC(C)(C)NC.... |
93 | 5RCB | - | RDM | C12 H15 N O3 | CC(=O)N[C@.... |
94 | 5RC6 | - | RBJ | C8 H11 N O | CNCc1ccc(c.... |
95 | 5RBQ | - | R8P | C8 H9 N O3 | C[C@@H](c1.... |
96 | 5R1V | - | R8S | C5 H8 N4 O | COc1ccnc(n.... |
97 | 5R1Z | - | R9M | C6 H7 N O2 S | c1csc(n1)C.... |
98 | 5R2B | - | RDY | C12 H15 N O4 | C[C@@H](C(.... |
99 | 5RC7 | - | AES | C8 H10 F N O2 S | c1cc(ccc1C.... |
100 | 5RBO | - | R8A | C6 H8 N2 O | c1cc(c(nc1.... |
101 | 5R26 | - | RCV | C10 H13 N O3 | COC(=O)COc.... |
102 | 5R1Y | - | R9J | C11 H15 N O2 | Cc1ccc(cc1.... |
103 | 5RBZ | - | R9S | C9 H11 N O | Cc1ccccc1C.... |
104 | 5R1X | - | RQD | C10 H12 F N O2 | COC(=O)[C@.... |
105 | 5RC8 | - | RCV | C10 H13 N O3 | COC(=O)COc.... |
106 | 5RC9 | - | RD4 | C9 H12 N2 O | [H]/N=C(c1.... |
107 | 5RBY | - | R9M | C6 H7 N O2 S | c1csc(n1)C.... |
108 | 5RCF | - | RE7 | C13 H16 F N3 | C[C@H](c1c.... |
109 | 5R24 | - | RB7 | C11 H16 Br N O2 S | Cc1cc(ccc1.... |
110 | 5R28 | - | RDJ | C9 H15 N3 O2 S | CCNC(=O)CS.... |
111 | 5RBT | - | RA7 | C8 H12 N2 O2 S | c1c(sc(n1).... |
112 | 5RCD | - | RDY | C12 H15 N O4 | C[C@@H](C(.... |
113 | 5RBR | - | R8S | C5 H8 N4 O | COc1ccnc(n.... |
114 | 5R2D | - | REG | C11 H20 N2 O2 | C1CCC(C1)N.... |
115 | 5RC0 | - | R9V | C14 H19 N O | c1ccc(cc1).... |
116 | 5R29 | - | RDM | C12 H15 N O3 | CC(=O)N[C@.... |
117 | 5R1T | - | R8A | C6 H8 N2 O | c1cc(c(nc1.... |
118 | 5R2A | - | RDV | C12 H22 N2 O | C1CCC(C1)C.... |
119 | 5R27 | - | RD4 | C9 H12 N2 O | [H]/N=C(c1.... |
120 | 5RBX | - | R9J | C11 H15 N O2 | Cc1ccc(cc1.... |
121 | 5RC1 | - | R9Y | C11 H16 N2 | CN1CCCc2c1.... |
122 | 5RCA | - | RDJ | C9 H15 N3 O2 S | CCNC(=O)CS.... |
123 | 5R22 | - | RA7 | C8 H12 N2 O2 S | c1c(sc(n1).... |
124 | 5RC2 | - | R8Y | C10 H13 N O3 S | CCN(CCC(=O.... |
125 | 5RBW | - | R9G | C12 H15 N O2 | COc1cccc(c.... |
126 | 5RBP | - | SYG | C9 H13 N O | CC[C@@H](c.... |
127 | 1PPM | Ki = 1600 nM | 0P1 | C29 H40 N3 O9 P | C[C@@H](C(.... |
128 | 2WED | Ki = 0.8 uM | PP6 | C29 H32 N2 O7 P | CC(C)[C@H].... |
129 | 1APU | Ki = 1.6 nM | IVA VAL VAL 32L | n/a | n/a |
130 | 2WEC | Ki = 110 uM | PP5 | C28 H32 N2 O7 P | CC(C)[C@@H.... |
131 | 1APW | Ki = 10 nM | IVA VAL VAL DFI NME | n/a | n/a |
132 | 1PPL | Ki = 2.8 nM | 1Z7 | C30 H50 N3 O8 P | CC(C)C[C@H.... |
133 | 2WEB | Ki = 7.6 uM | PP4 | C28 H32 N2 O7 P | CC(C)[C@@H.... |
134 | 2WEA | - | PP6 | C29 H32 N2 O7 P | CC(C)[C@H].... |
135 | 1BXO | Ki = 0.1 nM | PP7 | C30 H47 N4 O9 P | CC(C)C[C@@.... |
136 | 1APT | - | IVA VAL VAL LTA | n/a | n/a |
137 | 1PPK | Ki = 22 nM | IVV | C24 H46 N3 O7 P | CCOC(=O)C[.... |
138 | 1BXQ | Ki = 42 nM | PP8 | C29 H47 N4 O9 P | CC(C)C[C@H.... |
139 | 1APV | Ki = 1 nM | IVA VAL VAL DFO NME | n/a | n/a |
140 | 1IZE | - | IVA VAL VAL STA ALA STA | n/a | n/a |
141 | 3EMY | - | IVA VAL VAL STA ALA STA | n/a | n/a |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 1 families. | |||||
1 | 1E81 | - | M91 | C34 H49 N5 O6 S | CSC[C@@H](.... |
2 | 4ZEA | - | IMI | C10 H17 N3 O2 S | C1[C@H]2[C.... |
3 | 3ER3 | Ki = 81 nM | 0EL | C51 H78 N8 O9 | NULL |
4 | 4Y4D | - | CFF | C8 H10 N4 O2 | Cn1cnc2c1C.... |
5 | 5LWT | - | 7B3 | C10 H13 N3 O | Cc1c2cnnc(.... |
6 | 1EPM | - | THR PHE GLN ALA PSA LEU ARG GLU | n/a | n/a |
7 | 1EED | Ki = 16.2 uM | 0EO | C34 H55 N3 O8 | CC(C)C[C@@.... |
8 | 3PMY | - | 41L | C15 H13 N3 O | c1ccc(cc1).... |
9 | 1OEX | - | BOC HIS PRO PHE ALA LOV ILE HIS | n/a | n/a |
10 | 4ER4 | Ki = 160 nM | PRO HIS PRO PHE HIS LAV ILE HIS LYS | n/a | n/a |
11 | 4LBT | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
12 | 3PWW | - | ROC | C38 H50 N6 O5 | CC(C)(C)NC.... |
13 | 4Y38 | Kd = 4 mM | 0A9 | C10 H13 N O2 | COC(=O)[C@.... |
14 | 2JJJ | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
15 | 1GVV | - | 0GM | C51 H61 N5 O6 | CC(C)C[C@H.... |
16 | 3PMU | - | F7L | C14 H20 F N O2 | c1ccc(c(c1.... |
17 | 5OJE | Ki = 6.1 uM | VSK | C22 H27 N3 O | Cc1cc(c(c(.... |
18 | 1GVT | - | 2ZS | C31 H48 N4 O7 S | CC(C)OC(=O.... |
19 | 1EPR | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
20 | 5MB5 | - | 46P | C8 H10 N4 S | Cc1c(sc(n1.... |
21 | 5MB7 | - | 4AV | C8 H9 Cl N2 O2 | CNCc1cc(cc.... |
22 | 4Y4G | - | GGB | C5 H12 N4 O3 | [H]/N=C(N).... |
23 | 3ER5 | Ki = 1 nM | PRO HIS PRO PHE HIS STA VAL ILE HIS LYS | n/a | n/a |
24 | 3URL | - | HIS SER LEU PHE HIS PUK THR PRO | n/a | n/a |
25 | 3PCZ | - | BAM | C7 H9 N2 | c1ccc(cc1).... |
26 | 2V00 | Kd = 0.22 mM | V15 | C12 H13 N3 O | c1ccc(cc1).... |
27 | 5LWR | - | 7B2 | C27 H29 Cl N9 O | Cc1c2cnn3c.... |
28 | 3PLL | - | F06 | C8 H9 Cl N2 S | [H]/N=C(N).... |
29 | 4ER2 | Ki = 0.5 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
30 | 4LP9 | ic50 = 0.62 uM | SER LEU PHE HIS 22G THR PRO | n/a | n/a |
31 | 3PRS | - | RIT | C37 H48 N6 O5 S2 | CC(C)c1nc(.... |
32 | 1ENT | Ki = 110 nM | 0EM | C32 H52 N6 O7 P | NULL |
33 | 1E80 | - | 0GQ | C41 H64 N10 O6 | CC[C@H](C).... |
34 | 5LWS | - | 7B2 | C27 H29 Cl N9 O | Cc1c2cnn3c.... |
35 | 3PBD | - | F05 | C8 H8 N2 | c1ccc2c(c1.... |
36 | 1OD1 | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
37 | 3WZ6 | Ki = 1.1 uM | IXZ | C27 H25 N3 O2 S | c1ccc(cc1).... |
38 | 5ER1 | Ki = 960 nM | 0HT | C28 H48 N4 O5 | CC[C@H](C).... |
39 | 1OEW | - | SER THR | n/a | n/a |
40 | 1EPQ | Ki = 6.5 nM | 0QF | C31 H52 N4 O7 S2 | CCS[C@@H](.... |
41 | 5MB3 | - | 5GL | C13 H20 N2 O S | CCCN1C2=C(.... |
42 | 2JJI | - | 0QS | C36 H56 F2 N7 O8 S | CC(C)(C)S(.... |
43 | 3PCW | - | FBF | C8 H7 F3 N2 | [H]/N=C(/c.... |
44 | 3PGI | - | F41 | C14 H18 N2 O3 | c1cc2c(cc1.... |
45 | 4Y3J | Kd = 6.8 mM | HIC | C7 H11 N3 O2 | Cn1cc(nc1).... |
46 | 1GVW | Ki = 110 nM | 0EM | C32 H52 N6 O7 P | NULL |
47 | 5ER2 | Ki = 0.27 uM | 0EK | C50 H77 N9 O9 | NULL |
48 | 1EPP | Ki = 69 nM | 1Z1 | C32 H57 N7 O6 S2 | CC[C@H](C).... |
49 | 2ER7 | ic50 = 0.7 nM | BOC HIS PRO PHE HIS LOV ILE HIS | n/a | n/a |
50 | 4KUP | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
51 | 3WZ7 | Ki = 1.8 uM | IXY | C28 H30 N4 O2 S | c1ccc(cc1).... |
52 | 1EPO | Ki = 11 nM | 2Z3 | C32 H49 F2 N5 O7 | NULL |
53 | 1ER8 | - | DHI PRO PHE HIS LEU LEU VAL TYR | n/a | n/a |
54 | 3WZ8 | Ki = 1.5 uM | IXV | C27 H25 N3 O2 S | c1ccc(cc1).... |
55 | 3PI0 | - | F91 | C14 H14 N2 O2 | c1cc2c(cc1.... |
56 | 1GVU | Ki = 1 nM | PRO HIS PRO PHE HIS STA VAL ILE HIS LYS | n/a | n/a |
57 | 1EPL | - | PRO LEU GLU PSA ARG LEU | n/a | n/a |
58 | 4Y3Y | Kd = 4.5 mM | DCL | C6 H15 N O | CC(C)C[C@@.... |
59 | 1E5O | - | 3AI | C23 H38 N4 O4 S | CC[C@H](C).... |
60 | 3PLD | - | F90 | C8 H9 Cl N2 S | [H]/N=C(N).... |
61 | 5MB0 | Kd = 1.4 mM | F91 | C14 H14 N2 O2 | c1cc2c(cc1.... |
62 | 2ER6 | Ki = 60 nM | PRO THR GLU PUK ARG GLU | n/a | n/a |
63 | 3URI | - | HIS PRO HIS LEU SER 13E ALA HIS | n/a | n/a |
64 | 4LHH | Ki = 6 uM | 1TZ | C21 H24 N4 O | Cc1cc(c(c(.... |
65 | 4Y48 | - | GLY PRO | n/a | n/a |
66 | 1E82 | - | M90 | C34 H49 N5 O6 S | CSC[C@@H](.... |
67 | 1EPN | - | 2ZS | C31 H48 N4 O7 S | CC(C)OC(=O.... |
68 | 2ER9 | Ki = 40 nM | BOC HIS PRO PHE HIS STA LEU PHE | n/a | n/a |
69 | 4Y4J | Kd = 3.4 mM | LNR | C8 H11 N O3 | c1cc(c(cc1.... |
70 | 1GVX | Ki = 60 nM | PRO THR GLU PUK ARG GLU | n/a | n/a |
71 | 3PM4 | - | F5N | C15 H13 N3 O | c1ccc(cc1).... |
72 | 3PB5 | - | F63 | C11 H12 N2 O2 | CNCc1ccc(o.... |
73 | 4ZE6 | Kd = 3.3 mM | 011 | C7 H15 N O2 | C(CCCN)CCC.... |
74 | 3PBZ | - | F02 | C11 H17 N3 O | CCN(CC)c1c.... |
75 | 4ER1 | Ki = 0.24 uM | 0ZP | C51 H68 N5 O4 | CC[C@H](C).... |
76 | 3OWN | Ki = 34 nM | 3OX | C37 H48 N4 O7 S | CC(C)CNC(=.... |
77 | 2G21 | - | L1B | C19 H24 N5 O | CCc1c(c(nc.... |
78 | 4RYC | ic50 = 0.08 uM | 3ZK | C27 H39 N3 O6 S | Cc1ccc(cc1.... |
79 | 3D91 | Kd = 131 pM | REM | C33 H50 N4 O6 S | CC(C)(C)S(.... |
80 | 1BIL | ic50 = 0.5 nM | 0IU | C34 H53 N5 O5 S | NULL |
81 | 3KM4 | ic50 = 1.3 nM | 22X | C28 H45 Cl N4 O3 | CC(=O)NCCC.... |
82 | 2G24 | - | 7IG | C19 H19 F2 N5 | CCc1c(c(nc.... |
83 | 2IL2 | Kd = 79 nM | LIX | C32 H38 N6 O5 S | CCc1c(c(nc.... |
84 | 5SY3 | ic50 = 43 uM | 74Z | C15 H15 N3 O S | c1cc(oc1)C.... |
85 | 4Q1N | ic50 = 0.2 nM | 2Y9 | C26 H42 N4 O4 | CCOC[C@@H].... |
86 | 2I4Q | ic50 = 0.007 uM | UA4 | C25 H27 F2 N5 O3 | CCc1c(c(nc.... |
87 | 2BKS | ic50 = 37 nM | PZ1 | C34 H41 N3 O6 | COc1ccccc1.... |
88 | 4S1G | Ki = 0.6 nM | 43T | C24 H29 F N4 O2 | C[C@@H](c1.... |
89 | 4XX3 | Ki = 56 nM | 70X | C23 H28 N4 O2 | [H]/N=C1/N.... |
90 | 2G1S | - | 4IG | C24 H25 F2 N5 O3 | CCc1c(c(nc.... |
91 | 2G20 | - | L1A | C33 H50 N6 O7 S2 | CC(C)C[C@@.... |
92 | 5SXN | ic50 = 11 uM | 74U | C19 H15 N3 O | c1ccc(cc1).... |
93 | 3G70 | ic50 = 0.4 nM | A5T | C33 H32 Cl3 F2 N3 O2 | c1cc(c(c(c.... |
94 | 2G1Y | - | 5IG | C20 H27 N5 O3 | CCc1c(c(nc.... |
95 | 2G1R | - | 3IG | C20 H26 N6 O3 | CCc1c(c(nc.... |
96 | 4GJC | ic50 = 0.09 uM | 0MJ | C27 H29 N3 O4 S | Cc1ccc(cc1.... |
97 | 4GJ8 | - | 0LW | C20 H23 N O S | c1ccc2c(c1.... |
98 | 5SY2 | ic50 = 11 uM | 74V | C18 H25 N5 O2 | CCN([C@H]1.... |
99 | 5KOS | ic50 = 1.5 nM | 6VS | C27 H46 N6 O4 | CC(C)CN([C.... |
100 | 3G72 | ic50 = 0.8 nM | A6T | C33 H32 Cl3 F2 N3 O2 | c1cc(c(c(c.... |
101 | 3G6Z | ic50 = 0.2 nM | A7T | C35 H39 Cl2 N3 O3 | Cc1cccc(c1.... |
102 | 3GW5 | ic50 = 0.47 nM | 72X | C28 H46 Cl N3 O3 | CNC[C@H](C.... |
103 | 3SFC | ic50 = 0.003 uM | S53 | C32 H29 F N4 O2 | Cc1ccc(cc1.... |
104 | 2IKO | Kd = 3571 nM | 7IG | C19 H19 F2 N5 | CCc1c(c(nc.... |
105 | 3K1W | - | BFX | C31 H31 Br Cl F N2 O2 | c1ccc(c(c1.... |
106 | 4XX4 | Ki = 44 nM | 70Y | C25 H30 N4 O2 | [H]/N=C1/N.... |
107 | 2FS4 | ic50 = 37 nM | PZ1 | C34 H41 N3 O6 | COc1ccccc1.... |
108 | 2BKT | ic50 = 23 nM | RPF | C31 H37 N3 O5 | COc1ccccc1.... |
109 | 4GJ5 | - | 0LR | C22 H23 N O | c1ccc(cc1).... |
110 | 2G22 | - | 6IG | C27 H35 N5 O | CCc1c(c(nc.... |
111 | 1RNE | ic50 = 2 nM | C60 | C39 H63 N5 O6 S | CCCCNC(=O).... |
112 | 2G26 | - | 3LG | C32 H35 N3 O7 | COc1ccccc1.... |
113 | 4Y6M | - | 48Q | C39 H52 N4 O4 | CCCN(CCC)C.... |
114 | 5YIE | Ki = 5.6 nM | 8VF | C39 H51 N5 O6 S | CCN(CCN)c1.... |
115 | 5YID | Ki = 4 nM | K95 | C37 H44 N4 O6 S2 | CC1([C@H](.... |
116 | 2IGX | - | A1T | C41 H49 N5 O2 | CCCCCc1ccc.... |
117 | 5YIC | Ki = 1.3 nM | 8VO | C37 H45 N5 O6 S2 | CC1([C@H](.... |
118 | 4CKU | ic50 = 0.15 uM | P2F | C38 H52 N4 O6 S | CCCN(CCC)C.... |
119 | 1XDH | - | IVA VAL VAL STA ALA STA | n/a | n/a |
120 | 1LF2 | - | R37 | C32 H41 N3 O4 | Cc1cccc(c1.... |
121 | 5YIB | Ki = 3.3 nM | 8VC | C40 H53 N5 O6 S | Cc1cc(cc(c.... |
122 | 1LEE | - | R36 | C32 H41 N3 O4 | Cc1cccc(c1.... |
123 | 5YIA | Ki = 3 nM | 8V9 | C37 H44 N4 O7 S2 | CC1([C@H](.... |
124 | 1XE5 | - | 5FE | C29 H47 F6 N5 O9 | C[C@@H](C(.... |
125 | 5RBV | - | RQD | C10 H12 F N O2 | COC(=O)[C@.... |
126 | 5RCG | - | REG | C11 H20 N2 O2 | C1CCC(C1)N.... |
127 | 5R1U | - | T9G | C9 H13 N O | CC[C@H](c1.... |
128 | 5RC3 | - | RAY | C11 H14 F N O3 | COCCOCC(=O.... |
129 | 5R21 | - | R9Y | C11 H16 N2 | CN1CCCc2c1.... |
130 | 5RCE | - | RE4 | C11 H13 N5 | Cc1cc(nc(n.... |
131 | 5RBS | - | R8V | C9 H9 N O2 | CN1[C@H](c.... |
132 | 5RBU | - | R97 | C10 H10 N2 S | Cc1csc(n1).... |
133 | 5R2C | - | RE4 | C11 H13 N5 | Cc1cc(nc(n.... |
134 | 5R20 | - | R9V | C14 H19 N O | c1ccc(cc1).... |
135 | 5RCC | - | RDV | C12 H22 N2 O | C1CCC(C1)C.... |
136 | 5RC4 | - | RB7 | C11 H16 Br N O2 S | Cc1cc(ccc1.... |
137 | 5R25 | - | RBJ | C8 H11 N O | CNCc1ccc(c.... |
138 | 5HCT | Ki = 0.0254 uM | 61P | C30 H30 N8 O2 | c1ccc2c(c1.... |
139 | 5R1W | - | R8Y | C10 H13 N O3 S | CCN(CCC(=O.... |
140 | 5R23 | - | RAY | C11 H14 F N O3 | COCCOCC(=O.... |
141 | 5RC5 | - | RBG | C10 H20 N2 O | CC(C)(C)NC.... |
142 | 5RCB | - | RDM | C12 H15 N O3 | CC(=O)N[C@.... |
143 | 5RC6 | - | RBJ | C8 H11 N O | CNCc1ccc(c.... |
144 | 5RBQ | - | R8P | C8 H9 N O3 | C[C@@H](c1.... |
145 | 5R1V | - | R8S | C5 H8 N4 O | COc1ccnc(n.... |
146 | 5R1Z | - | R9M | C6 H7 N O2 S | c1csc(n1)C.... |
147 | 5R2B | - | RDY | C12 H15 N O4 | C[C@@H](C(.... |
148 | 5RC7 | - | AES | C8 H10 F N O2 S | c1cc(ccc1C.... |
149 | 5RBO | - | R8A | C6 H8 N2 O | c1cc(c(nc1.... |
150 | 5R26 | - | RCV | C10 H13 N O3 | COC(=O)COc.... |
151 | 5R1Y | - | R9J | C11 H15 N O2 | Cc1ccc(cc1.... |
152 | 5RBZ | - | R9S | C9 H11 N O | Cc1ccccc1C.... |
153 | 5R1X | - | RQD | C10 H12 F N O2 | COC(=O)[C@.... |
154 | 5RC8 | - | RCV | C10 H13 N O3 | COC(=O)COc.... |
155 | 5RC9 | - | RD4 | C9 H12 N2 O | [H]/N=C(c1.... |
156 | 5RBY | - | R9M | C6 H7 N O2 S | c1csc(n1)C.... |
157 | 5RCF | - | RE7 | C13 H16 F N3 | C[C@H](c1c.... |
158 | 5R24 | - | RB7 | C11 H16 Br N O2 S | Cc1cc(ccc1.... |
159 | 5R28 | - | RDJ | C9 H15 N3 O2 S | CCNC(=O)CS.... |
160 | 5RBT | - | RA7 | C8 H12 N2 O2 S | c1c(sc(n1).... |
161 | 5RCD | - | RDY | C12 H15 N O4 | C[C@@H](C(.... |
162 | 5RBR | - | R8S | C5 H8 N4 O | COc1ccnc(n.... |
163 | 5R2D | - | REG | C11 H20 N2 O2 | C1CCC(C1)N.... |
164 | 5RC0 | - | R9V | C14 H19 N O | c1ccc(cc1).... |
165 | 5R29 | - | RDM | C12 H15 N O3 | CC(=O)N[C@.... |
166 | 5R1T | - | R8A | C6 H8 N2 O | c1cc(c(nc1.... |
167 | 5R2A | - | RDV | C12 H22 N2 O | C1CCC(C1)C.... |
168 | 5R27 | - | RD4 | C9 H12 N2 O | [H]/N=C(c1.... |
169 | 5RBX | - | R9J | C11 H15 N O2 | Cc1ccc(cc1.... |
170 | 5RC1 | - | R9Y | C11 H16 N2 | CN1CCCc2c1.... |
171 | 5RCA | - | RDJ | C9 H15 N3 O2 S | CCNC(=O)CS.... |
172 | 5R22 | - | RA7 | C8 H12 N2 O2 S | c1c(sc(n1).... |
173 | 5RC2 | - | R8Y | C10 H13 N O3 S | CCN(CCC(=O.... |
174 | 5RBW | - | R9G | C12 H15 N O2 | COc1cccc(c.... |
175 | 5RBP | - | SYG | C9 H13 N O | CC[C@@H](c.... |
176 | 1PPM | Ki = 1600 nM | 0P1 | C29 H40 N3 O9 P | C[C@@H](C(.... |
177 | 2WED | Ki = 0.8 uM | PP6 | C29 H32 N2 O7 P | CC(C)[C@H].... |
178 | 1APU | Ki = 1.6 nM | IVA VAL VAL 32L | n/a | n/a |
179 | 2WEC | Ki = 110 uM | PP5 | C28 H32 N2 O7 P | CC(C)[C@@H.... |
180 | 1APW | Ki = 10 nM | IVA VAL VAL DFI NME | n/a | n/a |
181 | 1PPL | Ki = 2.8 nM | 1Z7 | C30 H50 N3 O8 P | CC(C)C[C@H.... |
182 | 2WEB | Ki = 7.6 uM | PP4 | C28 H32 N2 O7 P | CC(C)[C@@H.... |
183 | 2WEA | - | PP6 | C29 H32 N2 O7 P | CC(C)[C@H].... |
184 | 1BXO | Ki = 0.1 nM | PP7 | C30 H47 N4 O9 P | CC(C)C[C@@.... |
185 | 1APT | - | IVA VAL VAL LTA | n/a | n/a |
186 | 1PPK | Ki = 22 nM | IVV | C24 H46 N3 O7 P | CCOC(=O)C[.... |
187 | 1BXQ | Ki = 42 nM | PP8 | C29 H47 N4 O9 P | CC(C)C[C@H.... |
188 | 1APV | Ki = 1 nM | IVA VAL VAL DFO NME | n/a | n/a |
189 | 1SMR | - | PIV HIS PRO PHE HIS LPL TYR TYR SER | n/a | n/a |
190 | 1QRP | - | HH0 | C36 H60 N5 O10 P | C[C@@H](C(.... |
191 | 1PSO | - | IVA VAL VAL STA ALA STA | n/a | n/a |
192 | 2QZX | ic50 = 6 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
193 | 2JXR | Ki = 90 nM | 2Z3 | C32 H49 F2 N5 O7 | NULL |
194 | 1FQ5 | Ki = 4 nM | 0GM | C51 H61 N5 O6 | CC(C)C[C@H.... |
195 | 1QS8 | - | IVA VAL VAL STA ALA STA | n/a | n/a |
196 | 1ZAP | Ki = 0.17 nM | A70 | C42 H70 N6 O5 | CCCC[C@@H].... |
197 | 1IZE | - | IVA VAL VAL STA ALA STA | n/a | n/a |
198 | 1WKR | - | IVA VAL VAL STA ALA STA | n/a | n/a |
199 | 5N7Q | - | IVA VAL VAL STA ALA STA | n/a | n/a |
200 | 5N70 | Kd ~ 3 nM | ALA PHE ARG ILE PRO LEU THR ARG | n/a | n/a |
201 | 3EMY | - | IVA VAL VAL STA ALA STA | n/a | n/a |
202 | 2H6T | Ki = 60 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
203 | 3FV3 | Ki = 0.3 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
204 | 3QVI | - | K95 | C37 H44 N4 O6 S2 | CC1([C@H](.... |
205 | 3APR | - | DHI PRO PHE HIS PUK VAL TYR | n/a | n/a |
206 | 6APR | Ki < 17 nM | IVA VAL VAL STA ALA STA | n/a | n/a |
207 | 5APR | Ki < 17 nM | HIS PRO PHE CYS STA LEU PHE DHL | n/a | n/a |
208 | 4APR | Ki = 200 nM | IVA HIS PRO PHE HIS STA LEU PHE | n/a | n/a |
209 | 1CZI | - | PRO PHI SMC NOR | n/a | n/a |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | FBF | 1 | 1 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | 3AE | 1.0000 |
2 | LR5 | 0.9975 |
3 | S7J | 0.9951 |
4 | 4NZ | 0.9771 |
5 | SNO | 0.9719 |
6 | 4NB | 0.9693 |
7 | LQ2 | 0.9672 |
8 | RNO | 0.9664 |
9 | AM4 | 0.9658 |
10 | M4S | 0.9607 |
11 | 4CM | 0.9605 |
12 | 4JC | 0.9579 |
13 | 36E | 0.9552 |
14 | AMH | 0.9537 |
15 | PNZ | 0.9497 |
16 | S0E | 0.9475 |
17 | EVF | 0.9463 |
18 | MAJ | 0.9462 |
19 | ANN | 0.9461 |
20 | 12T | 0.9445 |
21 | Z13 | 0.9427 |
22 | BPN | 0.9424 |
23 | L14 | 0.9420 |
24 | E5X | 0.9414 |
25 | ICB | 0.9410 |
26 | KBZ | 0.9402 |
27 | TSU | 0.9397 |
28 | BZ2 | 0.9391 |
29 | 3W8 | 0.9387 |
30 | ZYX | 0.9373 |
31 | MSR | 0.9372 |
32 | ESP | 0.9362 |
33 | K4V | 0.9354 |
34 | AMS | 0.9352 |
35 | QBP | 0.9343 |
36 | 4JE | 0.9340 |
37 | 4BZ | 0.9321 |
38 | SKF | 0.9321 |
39 | ESX | 0.9320 |
40 | 6FZ | 0.9320 |
41 | 259 | 0.9313 |
42 | SNU | 0.9313 |
43 | BL0 | 0.9308 |
44 | F4E | 0.9308 |
45 | 4J8 | 0.9304 |
46 | SAN | 0.9303 |
47 | K97 | 0.9293 |
48 | EUE | 0.9293 |
49 | AES | 0.9293 |
50 | 3VS | 0.9283 |
51 | TZF | 0.9277 |
52 | 6NT | 0.9271 |
53 | ZEC | 0.9270 |
54 | 1F1 | 0.9255 |
55 | 428 | 0.9253 |
56 | A7N | 0.9253 |
57 | 4NM | 0.9249 |
58 | I3E | 0.9248 |
59 | 4WL | 0.9241 |
60 | 4BY | 0.9237 |
61 | VC3 | 0.9234 |
62 | JAW | 0.9229 |
63 | 6KT | 0.9229 |
64 | SN4 | 0.9229 |
65 | 6NI | 0.9227 |
66 | AN3 | 0.9217 |
67 | 0HN | 0.9211 |
68 | GJP | 0.9211 |
69 | 3ZB | 0.9202 |
70 | 4NP | 0.9201 |
71 | 9ZE | 0.9198 |
72 | 27B | 0.9197 |
73 | 5LA | 0.9196 |
74 | FCR | 0.9193 |
75 | P9E | 0.9191 |
76 | AZM | 0.9190 |
77 | 4BL | 0.9186 |
78 | 4MB | 0.9185 |
79 | CPZ | 0.9179 |
80 | 0JD | 0.9178 |
81 | 5NI | 0.9177 |
82 | SLS | 0.9163 |
83 | 4NS | 0.9162 |
84 | FBS | 0.9158 |
85 | PPY | 0.9156 |
86 | 2ZM | 0.9155 |
87 | E1T | 0.9149 |
88 | 15N | 0.9144 |
89 | IOS | 0.9137 |
90 | 4ZA | 0.9134 |
91 | 8WO | 0.9133 |
92 | 3A9 | 0.9132 |
93 | DVQ | 0.9129 |
94 | 3VX | 0.9129 |
95 | 0HO | 0.9126 |
96 | JDN | 0.9123 |
97 | UNJ | 0.9122 |
98 | EXD | 0.9121 |
99 | 3NY | 0.9119 |
100 | RYV | 0.9117 |
101 | BHQ | 0.9116 |
102 | GO2 | 0.9116 |
103 | YZM | 0.9116 |
104 | 4FH | 0.9113 |
105 | HIS | 0.9104 |
106 | 88L | 0.9103 |
107 | PNP | 0.9101 |
108 | 8ZE | 0.9099 |
109 | 4P5 | 0.9098 |
110 | ATX | 0.9097 |
111 | STX | 0.9096 |
112 | 2HU | 0.9095 |
113 | 363 | 0.9094 |
114 | N91 | 0.9092 |
115 | 5GT | 0.9086 |
116 | BZ3 | 0.9083 |
117 | A7H | 0.9081 |
118 | F4K | 0.9079 |
119 | 152 | 0.9079 |
120 | SSC | 0.9077 |
121 | 4RU | 0.9074 |
122 | X0V | 0.9069 |
123 | XCG | 0.9069 |
124 | AAS | 0.9066 |
125 | 2HC | 0.9059 |
126 | 6FB | 0.9058 |
127 | ABI | 0.9054 |
128 | 3W3 | 0.9054 |
129 | 3W6 | 0.9054 |
130 | 4LW | 0.9052 |
131 | PIM | 0.9044 |
132 | PHB | 0.9042 |
133 | 1FD | 0.9038 |
134 | 1HN | 0.9038 |
135 | CWJ | 0.9037 |
136 | OOG | 0.9036 |
137 | 4MA | 0.9035 |
138 | IAC | 0.9034 |
139 | A5P | 0.9031 |
140 | 657 | 0.9031 |
141 | PZM | 0.9029 |
142 | HHI | 0.9029 |
143 | TYL | 0.9028 |
144 | XIY | 0.9027 |
145 | N2I | 0.9026 |
146 | S7A | 0.9023 |
147 | 1X4 | 0.9022 |
148 | DXP | 0.9021 |
149 | Z82 | 0.9021 |
150 | BQ2 | 0.9020 |
151 | J6W | 0.9019 |
152 | N2M | 0.9018 |
153 | F02 | 0.9017 |
154 | 94W | 0.9016 |
155 | AAN | 0.9013 |
156 | 5OB | 0.9008 |
157 | JB8 | 0.9003 |
158 | E4P | 0.9001 |
159 | 2QC | 0.8998 |
160 | KMY | 0.8998 |
161 | E7S | 0.8997 |
162 | MP5 | 0.8995 |
163 | 1L5 | 0.8993 |
164 | 4I8 | 0.8993 |
165 | TMG | 0.8990 |
166 | HBD | 0.8988 |
167 | KTW | 0.8987 |
168 | A5Q | 0.8987 |
169 | 7O4 | 0.8985 |
170 | ESI | 0.8985 |
171 | TCA | 0.8985 |
172 | X0U | 0.8983 |
173 | GWM | 0.8980 |
174 | 9R5 | 0.8978 |
175 | PAB | 0.8978 |
176 | 1M2 | 0.8978 |
177 | EKZ | 0.8977 |
178 | 2BG | 0.8976 |
179 | NPO | 0.8962 |
180 | 1Y6 | 0.8961 |
181 | HA5 | 0.8961 |
182 | IFP | 0.8959 |
183 | XIZ | 0.8959 |
184 | BNL | 0.8955 |
185 | YI6 | 0.8953 |
186 | C1M | 0.8952 |
187 | QMR | 0.8950 |
188 | 9NB | 0.8949 |
189 | UA5 | 0.8948 |
190 | 2O6 | 0.8948 |
191 | 36Y | 0.8947 |
192 | 3R4 | 0.8946 |
193 | N1E | 0.8943 |
194 | 5XC | 0.8942 |
195 | 4JQ | 0.8940 |
196 | THA | 0.8940 |
197 | HDH | 0.8939 |
198 | 9CA | 0.8939 |
199 | PBZ | 0.8934 |
200 | HNT | 0.8934 |
201 | D5X | 0.8934 |
202 | 1SA | 0.8932 |
203 | AA | 0.8932 |
204 | CH9 | 0.8928 |
205 | N4E | 0.8927 |
206 | Y3L | 0.8926 |
207 | J9N | 0.8924 |
208 | 8XL | 0.8923 |
209 | GNM | 0.8923 |
210 | QIV | 0.8919 |
211 | DEZ | 0.8918 |
212 | A5E | 0.8918 |
213 | 9FL | 0.8918 |
214 | 174 | 0.8917 |
215 | OQC | 0.8914 |
216 | KYN | 0.8914 |
217 | ST3 | 0.8913 |
218 | HX4 | 0.8911 |
219 | 2BX | 0.8910 |
220 | MQN | 0.8909 |
221 | J9Q | 0.8908 |
222 | PIY | 0.8907 |
223 | DZA | 0.8906 |
224 | IWT | 0.8904 |
225 | BZJ | 0.8899 |
226 | ANF | 0.8899 |
227 | KDV | 0.8898 |
228 | PO6 | 0.8897 |
229 | 9BF | 0.8895 |
230 | 3VQ | 0.8895 |
231 | FQX | 0.8888 |
232 | 61M | 0.8884 |
233 | 1IT | 0.8883 |
234 | 5TY | 0.8883 |
235 | BVA | 0.8882 |
236 | 3XR | 0.8881 |
237 | 15E | 0.8880 |
238 | 0BP | 0.8877 |
239 | 54Z | 0.8874 |
240 | 4SX | 0.8873 |
241 | KTJ | 0.8872 |
242 | MAH | 0.8872 |
243 | 1A7 | 0.8871 |
244 | NAG | 0.8870 |
245 | 3PG | 0.8868 |
246 | 826 | 0.8867 |
247 | X48 | 0.8867 |
248 | 2A9 | 0.8864 |
249 | DHB | 0.8861 |
250 | 1VK | 0.8861 |
251 | HC4 | 0.8856 |
252 | E79 | 0.8853 |
253 | TIH | 0.8852 |
254 | OTR | 0.8852 |
255 | 8NB | 0.8852 |
256 | 4YO | 0.8849 |
257 | 7MW | 0.8848 |
258 | 549 | 0.8845 |
259 | 6RQ | 0.8844 |
260 | 0TU | 0.8843 |
261 | 13P | 0.8842 |
262 | DHC | 0.8842 |
263 | 86L | 0.8840 |
264 | AC6 | 0.8840 |
265 | F9Y | 0.8838 |
266 | 52C | 0.8838 |
267 | 56D | 0.8837 |
268 | BP7 | 0.8837 |
269 | R9Y | 0.8834 |
270 | UFV | 0.8834 |
271 | FHC | 0.8833 |
272 | TGX | 0.8833 |
273 | FBB | 0.8832 |
274 | 3HG | 0.8827 |
275 | V1T | 0.8823 |
276 | SG2 | 0.8823 |
277 | PJW | 0.8822 |
278 | 9FH | 0.8820 |
279 | URO | 0.8820 |
280 | IHB | 0.8818 |
281 | ODO | 0.8813 |
282 | 1A5 | 0.8812 |
283 | EYV | 0.8811 |
284 | 6QF | 0.8811 |
285 | MPV | 0.8811 |
286 | RA7 | 0.8809 |
287 | 2FX | 0.8808 |
288 | 535 | 0.8805 |
289 | INO | 0.8804 |
290 | GF4 | 0.8802 |
291 | 80G | 0.8801 |
292 | C53 | 0.8799 |
293 | 4FA | 0.8799 |
294 | I2E | 0.8797 |
295 | JBZ | 0.8796 |
296 | CSN | 0.8796 |
297 | 92G | 0.8796 |
298 | JG8 | 0.8795 |
299 | FZM | 0.8794 |
300 | AKG | 0.8792 |
301 | 5GV | 0.8791 |
302 | LR8 | 0.8790 |
303 | DDU | 0.8789 |
304 | FA0 | 0.8787 |
305 | 0F3 | 0.8785 |
306 | CLW | 0.8784 |
307 | DE5 | 0.8781 |
308 | BHA | 0.8781 |
309 | HQJ | 0.8781 |
310 | RP3 | 0.8781 |
311 | ALE | 0.8780 |
312 | PHE | 0.8779 |
313 | HFA | 0.8778 |
314 | DER | 0.8778 |
315 | 9FE | 0.8778 |
316 | 7VP | 0.8777 |
317 | EN1 | 0.8777 |
318 | K3D | 0.8776 |
319 | FUD | 0.8776 |
320 | DOB | 0.8775 |
321 | ODK | 0.8774 |
322 | 5QY | 0.8773 |
323 | BPY | 0.8772 |
324 | AOT | 0.8770 |
325 | PFL | 0.8770 |
326 | SW7 | 0.8770 |
327 | RHU | 0.8768 |
328 | PH3 | 0.8767 |
329 | 1P8 | 0.8767 |
330 | 4M0 | 0.8767 |
331 | ES2 | 0.8766 |
332 | R1P | 0.8765 |
333 | K2T | 0.8764 |
334 | 717 | 0.8764 |
335 | 97T | 0.8761 |
336 | ENO | 0.8760 |
337 | D48 | 0.8760 |
338 | 3PF | 0.8760 |
339 | LLH | 0.8760 |
340 | M3H | 0.8759 |
341 | HHH | 0.8758 |
342 | DHI | 0.8757 |
343 | R20 | 0.8757 |
344 | 3HM | 0.8756 |
345 | ANC | 0.8755 |
346 | H5B | 0.8755 |
347 | IPB | 0.8754 |
348 | FHB | 0.8754 |
349 | CHB | 0.8754 |
350 | 1Z6 | 0.8754 |
351 | K7H | 0.8751 |
352 | MS9 | 0.8751 |
353 | ET2 | 0.8750 |
354 | P9P | 0.8750 |
355 | GVY | 0.8748 |
356 | HNK | 0.8747 |
357 | P81 | 0.8747 |
358 | H42 | 0.8746 |
359 | MR1 | 0.8746 |
360 | HIC | 0.8744 |
361 | R5P | 0.8744 |
362 | FF2 | 0.8743 |
363 | HCI | 0.8740 |
364 | NF3 | 0.8740 |
365 | ST2 | 0.8740 |
366 | TYR | 0.8737 |
367 | HHS | 0.8737 |
368 | NNO | 0.8735 |
369 | NFA | 0.8735 |
370 | KMH | 0.8734 |
371 | 4XF | 0.8732 |
372 | 0FN | 0.8730 |
373 | 2FY | 0.8727 |
374 | 1PS | 0.8727 |
375 | 8NX | 0.8724 |
376 | PQK | 0.8722 |
377 | 0NX | 0.8721 |
378 | 7UC | 0.8720 |
379 | GZ2 | 0.8720 |
380 | 4AA | 0.8720 |
381 | 8U3 | 0.8719 |
382 | 4NC | 0.8719 |
383 | 0W1 | 0.8716 |
384 | DPN | 0.8716 |
385 | NDG | 0.8716 |
386 | 4A3 | 0.8715 |
387 | L22 | 0.8715 |
388 | 68A | 0.8711 |
389 | ZYR | 0.8711 |
390 | P80 | 0.8711 |
391 | 5RP | 0.8710 |
392 | CCU | 0.8710 |
393 | 93K | 0.8709 |
394 | L99 | 0.8708 |
395 | VD9 | 0.8705 |
396 | 3QV | 0.8704 |
397 | FDR | 0.8702 |
398 | PRL | 0.8701 |
399 | 5XB | 0.8701 |
400 | 2K8 | 0.8700 |
401 | YRL | 0.8698 |
402 | GF1 | 0.8697 |
403 | 5CU | 0.8697 |
404 | E3X | 0.8697 |
405 | 36R | 0.8696 |
406 | AHN | 0.8696 |
407 | 2HO | 0.8695 |
408 | 0FK | 0.8692 |
409 | DNA | 0.8692 |
410 | 344 | 0.8689 |
411 | VGD | 0.8687 |
412 | A29 | 0.8687 |
413 | QSB | 0.8685 |
414 | KYA | 0.8684 |
415 | LNR | 0.8683 |
416 | M45 | 0.8683 |
417 | 4LV | 0.8681 |
418 | 5NU | 0.8681 |
419 | PGH | 0.8680 |
420 | JWB | 0.8679 |
421 | TWO | 0.8676 |
422 | JA5 | 0.8675 |
423 | TRP | 0.8674 |
424 | HNL | 0.8671 |
425 | HG3 | 0.8669 |
426 | 2F6 | 0.8664 |
427 | LDP | 0.8660 |
428 | SOR | 0.8659 |
429 | 8W9 | 0.8659 |
430 | 4HP | 0.8659 |
431 | JCZ | 0.8659 |
432 | MYJ | 0.8657 |
433 | 2KA | 0.8656 |
434 | BIK | 0.8653 |
435 | AEF | 0.8652 |
436 | SEP | 0.8651 |
437 | GP9 | 0.8651 |
438 | TT4 | 0.8650 |
439 | 1OS | 0.8649 |
440 | PFF | 0.8644 |
441 | 8D6 | 0.8643 |
442 | DHR | 0.8642 |
443 | SYV | 0.8640 |
444 | MD6 | 0.8638 |
445 | BBK | 0.8636 |
446 | ZHA | 0.8636 |
447 | KW8 | 0.8633 |
448 | E0O | 0.8631 |
449 | 9TW | 0.8631 |
450 | 795 | 0.8631 |
451 | 5VM | 0.8631 |
452 | 4FS | 0.8630 |
453 | PPT | 0.8629 |
454 | 4V2 | 0.8629 |
455 | Q07 | 0.8624 |
456 | 449 | 0.8623 |
457 | 8HC | 0.8622 |
458 | 03V | 0.8622 |
459 | N2Z | 0.8620 |
460 | XDK | 0.8619 |
461 | JB5 | 0.8618 |
462 | ES5 | 0.8617 |
463 | JAH | 0.8616 |
464 | 5GU | 0.8613 |
465 | PQS | 0.8613 |
466 | J5I | 0.8609 |
467 | PEY | 0.8608 |
468 | APS | 0.8607 |
469 | A2G | 0.8599 |
470 | S2G | 0.8599 |
471 | YIE | 0.8599 |
472 | FLC | 0.8598 |
473 | 2AQ | 0.8598 |
474 | NGA | 0.8597 |
475 | 5RO | 0.8596 |
476 | COU | 0.8596 |
477 | CCD | 0.8596 |
478 | GDL | 0.8595 |
479 | PUE | 0.8590 |
480 | CIT | 0.8588 |
481 | 30G | 0.8588 |
482 | BEA | 0.8587 |
483 | TTL | 0.8585 |
484 | 4TU | 0.8580 |
485 | ARP | 0.8578 |
486 | C82 | 0.8578 |
487 | XDE | 0.8577 |
488 | PMP | 0.8577 |
489 | HBA | 0.8575 |
490 | OCH | 0.8573 |
491 | NCT | 0.8573 |
492 | SWX | 0.8573 |
493 | BDP | 0.8572 |
494 | 86J | 0.8571 |
495 | 92P | 0.8571 |
496 | 173 | 0.8570 |
497 | AX7 | 0.8558 |
498 | JRB | 0.8556 |
499 | SE2 | 0.8555 |
500 | P7Y | 0.8554 |
501 | PQM | 0.8551 |
502 | HJ7 | 0.8544 |
503 | 7W1 | 0.8544 |
504 | 4XS | 0.8543 |
505 | L15 | 0.8542 |
506 | DX3 | 0.8538 |
507 | 2FQ | 0.8533 |
508 | DHY | 0.8527 |
509 | FOM | 0.8521 |
510 | K82 | 0.8521 |
511 | 3DM | 0.8515 |
This union binding pocket(no: 1) in the query (biounit: 4er2.bio1) has 39 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
1 | 1J71 | THR ILE THR SER | 42.4242 |