On Target GASR_HUMAN 0.3292683/CHEMBL329286
For the given ligand YJING, we have found in our database that, being scored 0.3292683, the most similar ligand is CHEMBL329286. Check out the elaboration below.
| YJING (Given Ligand) | CHEMBL329286 (Similar Ligand) |
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| Fc4ccc(COc2ccc(CNCC1CCCCC1)cc2OCc3ccc(F)cc3)cc4 | COc1ccc(NC(=O)N[C@@H]2C[C@@H](C[C@@H](N(CC(=O)NC(C)(C)C)C2=O)c3ccccc3)c4ccccc4C)cc1 |
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| 04000000 45000008 20100108 02210600 00001000 00004010 02040000 22001000 00000100 000008c0 00200000 40018000 00804802 00011080 01000401 02088008 00000000 02000200 02482000 00120201 00000000 18008030 00000000 00d49010 00000000 c0002000 00220000 90000001 00000300 00068008 60060000 00000200 | 00018006 01803208 2010010a 04010e00 00001000 00000000 02000004 22003009 00100800 000b08c0 08380004 4001b000 0600b82a 00302001 81000461 02060008 00040010 02400000 08002000 80020201 c0000100 38058630 20026003 02500018 00110000 c0000001 00040000 90000080 08008302 0006000b 200e4000 00406600 |