On Target ACE2_HUMAN 0.203125/CHEMBL258333
For the given ligand 4, we have found in our database that, being scored 0.203125, the most similar ligand is CHEMBL258333. Check out the elaboration below.
| 4 (Given Ligand) | CHEMBL258333 (Similar Ligand) |
|---|---|
| CCCC=c1oc(=O)c2ccccc12 | O=C(CS)N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O |
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| 00280000 00010800 00000300 00010201 02000011 0800d000 80000080 00000400 00000100 40100840 08000000 40008800 80028000 00210000 02000002 02080008 00020400 02000200 00044000 00200001 00100000 08020b20 00208020 80400014 01000400 80002000 00483001 c0000000 00404200 00020000 c4000000 00000000 | 00002000 00005000 00100100 00110600 00000080 00000000 80000000 00000004 00000980 020a0840 08300000 4000b800 06008002 00040000 00000000 00080008 10020000 02000000 04400008 10000201 00000100 18200e00 13000040 85400018 00000800 80000000 00000000 00000040 04004000 00060003 20004000 02010600 |