On Target CXCR3_HUMAN 0.38129497/CHEMBL458422
For the given ligand cocaine , we have found in our database that, being scored 0.38129497, the most similar ligand is CHEMBL458422. Check out the elaboration below.
| cocaine (Given Ligand) | CHEMBL458422 (Similar Ligand) |
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| COC(=O)[C@H]2[C@@H](OC(=O)c1ccccc1)C[C@H]3CC[C@@H]2N3C | OC(=O)c1cccc(c1)C2(CCC(=O)NC2=O)C3CCN(Cc4ccc(Br)cc4)CC3 |
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| 00010000 01000800 00100100 00010700 000c0050 00204010 00000000 20000000 00000100 010008c0 00200000 50019000 1c00801a 01890000 00000000 02081008 00a20000 02000000 01c02010 00000201 00000020 18020a30 01000080 00500014 00001401 80002000 00088000 10001000 00000200 0006000e c0020000 02002200 | 00014000 01009800 00100102 00010600 00001001 00004000 00000000 22001004 00100980 000a0ac0 28300000 50019000 0500881a 00200000 40000400 08080008 00000000 02000800 00002000 40000201 00020100 18268e30 01000000 8150001c 00000000 c0000000 00120000 90004000 04000100 00060003 e0062008 08402600 |