Drug Information

Drug General Information
Drug ID
D0J4VA
Former ID
DNC011033
Drug Name
3-fluoro-4'-(1-(pyridin-4-yl)propyl)biphenyl-4-ol
Drug Type
Small molecular drug
Indication Discovery agent Investigative [530974]
Structure
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2D MOL

3D MOL
Formula
C20H18FNO
Canonical SMILES
CCC(C1=CC=C(C=C1)C2=CC(=C(C=C2)O)F)C3=CC=NC=C3
InChI
1S/C20H18FNO/c1-2-18(16-9-11-22-12-10-16)15-5-3-14(4-6-15)17-7-8-20(23)19(21)13-17/h3-13,18,23H,2H2,1H3
InChIKey
MSZSUMNJIMRHDP-UHFFFAOYSA-N
PubChem Compound ID
46854606
Target and Pathway
Target(s) 17 alpha-hydroxylase-C17, 20-lyase Target Info Inhibitor [530974]
BioCyc Pathway Superpathway of steroid hormone biosynthesis
Glucocorticoid biosynthesis
Androgen biosynthesis
KEGG Pathway Steroid hormone biosynthesis
Metabolic pathways
Ovarian steroidogenesis
Prolactin signaling pathway
PathWhiz Pathway Androgen and Estrogen Metabolism
Steroidogenesis
Reactome Androgen biosynthesis
Glucocorticoid biosynthesis
Endogenous sterols
WikiPathways Metapathway biotransformation
Steroid Biosynthesis
Oxidation by Cytochrome P450
Metabolism of steroid hormones and vitamin D
Glucocorticoid & Mineralcorticoid Metabolism
Prostate Cancer
Phase 1 - Functionalization of compounds
References
Ref 530974J Med Chem. 2010 Jul 8;53(13):5049-53.Isopropylidene substitution increases activity and selectivity of biphenylmethylene 4-pyridine type CYP17 inhibitors.
Ref 530974J Med Chem. 2010 Jul 8;53(13):5049-53.Isopropylidene substitution increases activity and selectivity of biphenylmethylene 4-pyridine type CYP17 inhibitors.

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