On Target GASR_HUMAN 0.4248366/CHEMBL103276
For the given ligand cocaine , we have found in our database that, being scored 0.4248366, the most similar ligand is CHEMBL103276. Check out the elaboration below.
| cocaine (Given Ligand) | CHEMBL103276 (Similar Ligand) |
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| COC(=O)[C@H]2[C@@H](OC(=O)c1ccccc1)C[C@H]3CC[C@@H]2N3C | Cc1cccc(NC(=O)N[C@H](CCC(=O)OCc2ccccc2)C(=O)N3CCC(CC3)C(=O)c4ccccc4)c1 |
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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 | 00030006 01003800 00100102 04010f00 04180010 00004000 00000004 20002009 00100900 000a08d0 08380004 5001b000 0400b032 09312000 00000040 02081008 00860010 02400000 08400000 00000201 40000120 38070e20 21022001 0250001c 00150400 80002000 00080200 10000080 08408200 00060003 e0084000 02806e00 |