On Target RT_HIV1 0.4516129/CHEMBL3683708
For the given ligand Ombitasvir, we have found in our database that, being scored 0.4516129, the most similar ligand is CHEMBL3683708. Check out the elaboration below.
| Ombitasvir (Given Ligand) | CHEMBL3683708 (Similar Ligand) |
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| COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)Nc6ccc([C@@H]4CC[C@@H](c3ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)OC)C(C)C)cc3)N4c5ccc(C(C)(C)C)cc5)cc6)C(C)C | COC(=O)N[C@H](C(=O)NCCC(F)(F)C[C@@H](CO)N(C(C)C)S(=O)(=O)c1ccc(N)cc1)C(c1ccccc1)c1ccccc1 |
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| 00014002 01003800 00100122 c4010600 20000000 0001a010 00000000 22001008 00900a00 00080ac0 08380004 4001f000 0e008812 0030a001 80020440 00120008 00062000 02080000 08002010 00000201 40100100 38048e30 20012003 0250001a 00000000 c0000002 00000000 900000a0 08008302 00060003 a0044000 00002600 | 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 d000006c 0c000680 2806000b a0004000 00012670 |