On Target AOFB_HUMAN 0.3740458/CHEMBL3407582
For the given ligand Dolutegravir, we have found in our database that, being scored 0.3740458, the most similar ligand is CHEMBL3407582. Check out the elaboration below.
| Dolutegravir (Given Ligand) | CHEMBL3407582 (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 | CN(CC#C)Cc1cc2cc(OCCCC3CCN(Cc4ccc(OC(=O)N(C)C)c5ncccc45)CC3)ccc2n1C |
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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 | 04000002 01008808 60104108 10010f00 004c3020 02100004 060c0000 22303001 04000200 000008c0 00210004 50058000 80808806 08c00000 11130541 021c210c 00820008 02002006 00602000 00020201 40000001 18018c18 31810000 8070a010 00106400 c0110002 00224440 90000000 00000304 00060041 20048200 10004220 |