On Target CASP1_HUMAN 0.4318182/CHEMBL468641
For the given ligand Dolutegravir, we have found in our database that, being scored 0.4318182, the most similar ligand is CHEMBL468641. Check out the elaboration below.
| Dolutegravir (Given Ligand) | CHEMBL468641 (Similar Ligand) |
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| C[C@@H]3CCO[C@H]4Cn2cc(C(=O)NCc1ccc(F)cc1F)c(=O)c(O)c2C(=O)N34 | CC(C)CC(=O)NC(=O)C1=CN(CCO)C(=CC1=O)C(OC(=O)C)c2ccccc2 |
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| 10000082 44c0fc08 60104100 d2010f90 0404102a 08128154 1c024000 82203401 02200301 805308d0 01290004 c0018000 80009806 08581100 00021c80 221e710c 02226200 82004106 00e00800 00160201 c0000021 383f8e10 23802081 6654013c 18152401 c0001082 08e00260 90240011 08440304 45068051 e40c0000 c0004200 | 1000000a 0180d800 02104100 50050650 00045032 0008c040 00004000 23001000 02000301 900a88d0 09208004 40819800 84009882 00410000 00020480 020e408c 00028000 82884005 00200000 00400201 c0020000 18048f30 a2800002 2450051c 00040400 e0002000 08880060 d0040010 04400384 4a060443 e0080000 e4000600 |