On Target CCR5_HUMAN 0.54761904/CHEMBL101333
For the given ligand Cocaine, we have found in our database that, being scored 0.54761904, the most similar ligand is CHEMBL101333. Check out the elaboration below.
| Cocaine (Given Ligand) | CHEMBL101333 (Similar Ligand) |
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| COC(=O)C2C(OC(=O)c1ccccc1)CC3CCC2N3C | OC1(CCCc2ccccc2)CCN(C[C@H]3CN(C[C@@H]3c4ccccc4)[C@H](C5CCCCC5)C(=O)OCc6ccccc6)CC1 |
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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 | 00010000 01000600 00100102 80010700 00080090 00004010 00000000 20000000 00200980 000809e0 08301000 5003b000 0600800a 00a10000 80081008 020c1008 10820000 02000000 02c02000 00000201 00000120 18200a30 13000080 81500010 00000401 80002000 00080000 10000001 04000202 0006001a 40024000 02002600 |