BDBM50484859 CHEMBL2012378

SMILES CO[C@@H]1[C@H](OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](OC)[C@@H]2OP(O)(=O)OCCCCCCNC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3cc(Br)c(O)c(Br)c3oc3c(Br)c(=O)c(Br)cc23)n2ccc(=O)[nH]c2=O)n2cnc3c2nc(N)[nH]c3=O)n2ccc(=O)[nH]c2=O)n2cnc3c2nc(N)[nH]c3=O)n2ccc(=O)[nH]c2=O)n2ccc(=O)[nH]c2=O)n2ccc(=O)[nH]c2=O)n2ccc(=O)[nH]c2=O)n2ccc(=O)[nH]c2=O)n2cnc3c2nc(N)[nH]c3=O)[C@@H](CO)O[C@H]1n1cnc2c1nc(N)[nH]c2=O

InChI Key InChIKey=JQNPNOVSPYQHFD-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50484859   

TargetIntegrase(Human immunodeficiency virus type 1)
Lomonosov Moscow State University

Curated by ChEMBL
LigandPNGBDBM50484859(CHEMBL2012378)
Affinity DataIC50: 48nMAssay Description:Inhibition of Human immunodeficiency virus 1 integrase 3'-processing activity expressed in Escherichia coli using 21-mer DNA and Mg2+ after 2 hrs by ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/29/2020
Entry Details Article
PubMed