On Target CXCR4_HUMAN 0.44129553/CHEMBL3893083
For the given ligand Dolutegravir, we have found in our database that, being scored 0.44129553, the most similar ligand is CHEMBL3893083. Check out the elaboration below.
| Dolutegravir (Given Ligand) | CHEMBL3893083 (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 | Cc1cccnc1CN(CCCCN)Cc2nccc3c4ccccc4n(CC(=O)N5CCOCC5)c23 |
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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 | 10000002 00005400 00104100 d0010e10 000c10e0 00100100 0000c000 22003003 00200000 000008c0 01210004 4003a000 00009802 01e00000 00161cc8 0e0c010c 18022000 c2000006 00600000 00000201 c0020000 38018e18 33800000 8240001a 08140400 c0000000 0880c040 90000001 08400704 00060011 200c0200 80004600 |