On Target RT_HIV1 0.555/CHEMBL3683710
For the given ligand Darunavir, we have found in our database that, being scored 0.555, the most similar ligand is CHEMBL3683710. Check out the elaboration below.
| Darunavir (Given Ligand) | CHEMBL3683710 (Similar Ligand) |
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| CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]2CO[C@H]3OCC[C@@H]23)S(=O)(=O)c4ccc(N)cc4 | COC(=O)N[C@H](C(=O)NCCC(F)C[C@@H](CO)N(C(C)C)S(=O)(=O)c1ccc(N)cc1)C(c1ccccc1)c1ccccc1 |
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| 00000012 01c07401 0110050a 01b10700 002800d0 00028000 00002800 a8000044 00742a00 014809e0 08302004 60018010 00008002 02200101 80e80040 003a9008 10822000 02080000 11408800 01007603 c0100120 18280c90 27100040 d9500058 02000400 8000100e 00000000 3420006c 04000600 2006001b 80200000 00012670 | 00000012 01803200 01100100 05b10600 00080090 00818000 00000000 2100000c 00c40a00 004808c0 08302004 6001b000 0c008002 00802001 80600040 001e0408 100a2000 02080000 00402018 00006609 c0000100 38240e30 23100001 db500058 02000800 a0000006 00000060 5000006c 0c000680 2806000b a0004000 00012670 |