On Target RT_HIV1 0.22715405/CHEMBL4112133
For the given ligand ICV813, we have found in our database that, being scored 0.22715405, the most similar ligand is CHEMBL4112133. Check out the elaboration below.
| ICV813 (Given Ligand) | CHEMBL4112133 (Similar Ligand) |
|---|---|
| COCCO/C4=C/C(Cl)=C\C(\C3=C\C(C1/C=C\C=C/C1C#N)CN(C2/C=N\C=C/C2)C3=O)C4 | COC(=O)N[C@H](C(=O)N[C@H](c1ccc([C@@H](CO)N(CCC(C)(C)C)S(=O)(=O)C2=CC3NC=C(Cl)C3C=C2)s1)C(F)(F)F)C(c1ccccc1)c1ccccc1 |
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| 00410012 89049000 08104000 80010d01 424d3000 04301401 10180180 30020442 11002008 021080c9 00230000 41419200 8402a122 09010000 02000400 0009910c 20c24800 40000340 40414082 03422209 20002821 300407a0 85009400 0c10081a 00720400 08008800 41484280 90040620 04004201 80040401 1c010800 46022280 | 00432021 4c94b201 06380100 45310603 500100c0 0033b9e5 400811a1 3348541e 00c61f08 c05918c2 49342600 c070ba80 bc068892 80652021 804c2400 001e024c 38c31000 0219194c 80300098 00804a0d c0003b41 7c288f90 43309100 d3700e7a 46800800 ec010002 40420801 d064213c 0c700390 400e070f e4004100 41c347f0 |