BDBM25441 5-(3-fluoro-4-methoxyphenyl)-1-(pyridin-4-yl)-2,3-dihydro-1H-inden-1-ol::Abiraterone mimetic, 4

SMILES COc1ccc(cc1F)-c1ccc2c(CCC2(O)c2ccncc2)c1

InChI Key InChIKey=VKGRHANZJPGGQL-UHFFFAOYSA-N

Data  4 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 4 hits for monomerid = 25441   

TargetSteroid 17-alpha-hydroxylase/17,20 lyase(Homo sapiens (Human))
Saarland University

LigandPNGBDBM25441(5-(3-fluoro-4-methoxyphenyl)-1-(pyridin-4-yl)-2,3-...)
Affinity DataIC50: >1.00E+4nMpH: 7.4 T: 2°CAssay Description:The 17 alpha-hydroxylase activity of CYP 17 was determined by measuring the conversion of progesterone into 17 alpha-hydroxyprogesterone and the bypr...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Saarland University

LigandPNGBDBM25441(5-(3-fluoro-4-methoxyphenyl)-1-(pyridin-4-yl)-2,3-...)
Affinity DataIC50:  3.36E+3nMAssay Description:To measure CYP3A4 activity, the product of testosterone 6-hydroxylation, 6beta-hydroxytestosterone was determined. After incubation, the reaction was...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 11B2, mitochondrial(Homo sapiens (Human))
Saarland University

LigandPNGBDBM25441(5-(3-fluoro-4-methoxyphenyl)-1-(pyridin-4-yl)-2,3-...)
Affinity DataIC50:  436nMAssay Description:The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 11B1, mitochondrial(Homo sapiens (Human))
Saarland University

LigandPNGBDBM25441(5-(3-fluoro-4-methoxyphenyl)-1-(pyridin-4-yl)-2,3-...)
Affinity DataIC50:  291nMAssay Description:The enzyme activity was assayed by monitoring the conversion of deoxycorticosterone to corticosterone in the presence of inhibitor compounds. The pro...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed