On Target NK1R_HUMAN 0.5483871/CHEMBL2115009
For the given ligand cocaine , we have found in our database that, being scored 0.5483871, the most similar ligand is CHEMBL2115009. Check out the elaboration below.
| cocaine (Given Ligand) | CHEMBL2115009 (Similar Ligand) |
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| COC(=O)[C@H]2[C@@H](OC(=O)c1ccccc1)C[C@H]3CC[C@@H]2N3C | Fc1ccc(cc1)C2CCN(CC2)[C@@H]3CC[C@](COC(=O)c4cc(cc(c4)C(F)(F)F)C(F)(F)F)(CC3)c5ccccc5 |
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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 | 00000000 010c0a00 00100102 02010700 00080051 00004010 00000400 20000040 00100900 000808d0 08300000 50018002 00008002 01a11000 00040000 0a0c1008 08820000 02000080 06402000 40100201 00010120 18020a30 01000000 00500014 00000400 80002000 00080000 90000001 00000202 0006800a c0120004 02002600 |