On Target NPSR1_HUMAN 0.31578946/CHEMBL230333
For the given ligand cocaine, we have found in our database that, being scored 0.31578946, the most similar ligand is CHEMBL230333. Check out the elaboration below.
| cocaine (Given Ligand) | CHEMBL230333 (Similar Ligand) |
|---|---|
| COC(=O)[C@H]2[C@@H](OC(=O)c1ccccc1)C[C@H]3CC[C@@H]2N3C | CSCC[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)O |
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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 | 00030000 01007600 00100100 04110e40 00000080 02000000 00000000 2000200c 84200a80 000a49c2 08300000 4007b000 1e01901a 00042001 84180000 001c0008 14001000 02000001 01802018 00000201 40000100 382d0e30 03000383 83500018 00001801 80000000 40000200 10000000 0c000012 0006003b a0084000 01812600 |