On Target TNFA_HUMAN 0.42906573/CHEMBL3640333
For the given ligand Dolutegravir, we have found in our database that, being scored 0.42906573, the most similar ligand is CHEMBL3640333. Check out the elaboration below.
| Dolutegravir (Given Ligand) | CHEMBL3640333 (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 | COc1ccc2CN(C[C@]3(NC(=O)NC3=O)C#Cc4ccc(CN5CCCCC5)nc4)C(=O)c2c1F |
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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 | 00000282 45827c08 28104908 96010e10 20443020 00148010 02040084 22103029 00000900 0003a9f0 40210004 5001b00c 8c00b842 18203000 01124421 221c010c 02002a10 02402007 00280010 80020211 c0020100 389b8680 20880001 2254881d 10141004 c0200001 08a242c0 90000001 08400304 08068011 a0144800 00006300 |