BDBM50036146 5-{1-(3-carboxy-5-chloro-4-hydroxyphenyl)-4-[1-(1,5-dimethylhexyl)-9a,11a-dimethyl-(7S,9aS,11aR)-perhydrocyclopenta[a]phenanthren-7-yl]-1-butenyl}-3-chloro-2-hydroxybenzoic acid::5-{1-(3-carboxy-5-chloro-4-hydroxyphenyl)-4-[1-(1,5-dimethylhexyl)-9a,11a-dimethyl-(9aS,11aR)-perhydrocyclopenta[a]phenanthren-7-yl]-1-butenyl}-3-chloro-2-hydroxybenzoic acid::5-{1-(3-carboxy-5-chloro-4-hydroxyphenyl)-4-[1-(1,5-dimethylhexyl)-9a,11a-dimethylperhydrocyclopenta[a]phenanthren-7-yl]-1-butenyl}-3-chloro-2-hydroxybenzoic acid::5-{1-(3-carboxy-5-chloro-4-hydroxyphenyl)-4-[1-(1,5-dimethylhexyl)-9a,11a-dimethylperhydrocyclopenta[a]phenanthren-7-yl]-1-butenyl}-3-chloro-2-hydroxybenzoic acid(cosalane)::5-{1-(3-carboxy-5-chloro-4-hydroxyphenyl-4-[1-(1,5-dimethylhexyl)-9a,11a-dimethylperhydrocyclopenta[a]phenanthren-7-yl]-1-butenyl}-3-chloro-2-hydroxy acetic acid (Cosalane)::CHEMBL300101::Cosalane

SMILES [#6]-[#6](-[#6])-[#6]-[#6]-[#6]-[#6](-[#6])-[#6@H]1-[#6]-[#6]-[#6]2-[#6]-3-[#6]-[#6]-[#6]4-[#6]-[#6@@H](-[#6]-[#6]\[#6]=[#6](\c5cc(Cl)c(-[#8])c(c5)-[#6](-[#8])=O)-c5cc(Cl)c(-[#8])c(c5)-[#6](-[#8])=O)-[#6]-[#6][C@]4([#6])[#6]-3-[#6]-[#6][C@]12[#6]

InChI Key InChIKey=VOJOOGPALCATLT-MJZFBSOMSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50036146   

TargetT-cell surface glycoprotein CD4(Homo sapiens (Human))
Purdue University

Curated by ChEMBL
LigandPNGBDBM50036146(5-{1-(3-carboxy-5-chloro-4-hydroxyphenyl)-4-[1-(1,...)
Affinity DataEC50:  4.00E+3nMAssay Description:In vitro inhibition of cytopathic effect was determined against HIV-2 ROD in MT-4 cells using MTS cytoprotection assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed