On Target PR_HIV1 0.16494845/CHEMBL3645128
For the given ligand XIE5-1-23, we have found in our database that, being scored 0.16494845, the most similar ligand is CHEMBL3645128. Check out the elaboration below.
| XIE5-1-23 (Given Ligand) | CHEMBL3645128 (Similar Ligand) |
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| N=C(N)N/N=C/c3ccc(OCc1ccccc1)c(OCc2ccccc2)c3 | COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)O[C@H]2CC3OCCO[C@@H]3C2)cc1 |
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| 04000008 40000008 20000108 00210a00 00003000 00004000 02040000 81084000 00000100 00000843 00000000 40008000 80804002 00010080 01000001 02088008 00000000 02000000 00480400 00020200 00080000 08000020 40040002 08c01000 00000000 80002800 40020100 00000000 00000228 000e0208 40100800 00000000 | 00000010 01c05408 2110010a 01b10700 002810c0 00028000 02000000 a0000044 00542a00 014809e0 08302000 60018000 00008002 02200101 81e80001 001a9008 10822000 02080000 11400800 01027603 80000120 18280c90 07100040 d9500058 02000400 8000100e 00800000 102200ac 04000600 2106001b 80000000 00012670 |