On Target ACES_HUMAN 0.6086956/CHEMBL313582
For the given ligand MIe-421, we have found in our database that, being scored 0.6086956, the most similar ligand is CHEMBL313582. Check out the elaboration below.
| MIe-421 (Given Ligand) | CHEMBL313582 (Similar Ligand) |
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| NC(=O)C3Oc1ccccc1C2CC23 | C[N+]1(Cc2ccccc2)CCC(CCC(=O)c3ccc4OCCCCc4c3)CC1 |
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| 04010000 01000018 6000010a 00010702 00081000 82000000 02000000 00000200 00110800 000808c0 08140000 4001d040 0480800a 01200000 11001001 00082008 00800000 a2028000 00402000 00020001 00000100 18040610 03000040 00400410 00000000 c0000000 00000008 00000000 00000302 00064002 00000000 00400400 | 04010000 01000808 6010010b 00010700 00081001 82000000 02040000 22001200 00000800 00080ac0 08300000 50019040 0480880a 00200000 11000401 08082008 00800000 22008000 00402000 00020201 00000100 18028210 01000000 00500414 00000000 c0000000 00120000 90800000 00000302 00064002 a0060000 00000600 |