On Target RT_HIV1 0.32247558/CHEMBL3900871
For the given ligand WIN55212-2, we have found in our database that, being scored 0.32247558, the most similar ligand is CHEMBL3900871. Check out the elaboration below.
| WIN55212-2 (Given Ligand) | CHEMBL3900871 (Similar Ligand) |
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| Cc4c(C(=O)c1cccc2ccccc12)c6cccc5OCC(CN3CCOCC3)n4c56 | CC(C)CN(C(CO)c1ccc(CNC(=O)C(NC(=O)c2ccccc2)C(c2ccccc2)c2cn(C)c3ccccc23)s1)S(=O)(=O)c1ccc2ncsc2c1 |
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| 0c000002 00801c08 60100109 d001061a 000450b0 06008104 0e842401 01200004 00600000 000a08c0 08200004 40058000 00808806 08608000 011a1849 020c610c 10214000 82800004 08a00400 00064200 c0000020 38268618 33804080 8650801c 08042441 e0000000 08120200 50000011 0a040284 40060052 a0044200 00000660 | 08038012 10803a00 03180108 45b10611 100c52c0 00028000 04006881 2300d00e 00460980 004918c0 09302a04 f001b880 9e20a832 00442821 806c24c0 080c160c 18413020 8291008c 00700418 00006e0d c0001900 782a8698 23900201 db41005c 42043800 ec010104 48000800 d000200c 0c200780 2006000f a0044200 00c107e0 |