Drug General Information
Drug ID
D0B5MZ
Former ID
DNC004612
Drug Name
3-(4-Amino-phenyl)-3-butyl-piperidine-2,6-dione
Drug Type
Small molecular drug
Indication Discovery agent Investigative [533478]
Structure
Download
2D MOL

3D MOL

Formula
C15H20N2O2
Canonical SMILES
CCCCC1(CCC(=O)NC1=O)C2=CC=C(C=C2)N
InChI
1S/C15H20N2O2/c1-2-3-9-15(10-8-13(18)17-14(15)19)11-4-6-12(16)7-5-11/h4-7H,2-3,8-10,16H2,1H3,(H,17,18,19)
InChIKey
HECRHMWBGLSDHM-UHFFFAOYSA-N
PubChem Compound ID
Target and Pathway
Target(s) Cytochrome P450 11A1, mitochondrial Target Info Inhibitor [533478]
Cytochrome P450 19 Target Info Inhibitor [533478]
BioCyc Pathway Superpathway of steroid hormone biosynthesis
Pregnenolone biosynthesisPWY-7305:Superpathway of steroid hormone biosynthesis
Estradiol biosynthesis II
Estradiol biosynthesis I
KEGG Pathway Steroid hormone biosynthesis
Metabolic pathways
Ovarian steroidogenesishsa00140:Steroid hormone biosynthesis
Ovarian steroidogenesis
NetPath Pathway FSH Signaling PathwayNetPath_25:FSH Signaling Pathway
PANTHER Pathway Androgen/estrogene/progesterone biosynthesis
PathWhiz Pathway SteroidogenesisPW000045:Androgen and Estrogen Metabolism
Reactome Endogenous sterolsR-HSA-211976:Endogenous sterols
WikiPathways Prostaglandin Synthesis and Regulation
Metapathway biotransformation
Oxidation by Cytochrome P450
Metabolism of steroid hormones and vitamin D
Glucocorticoid & Mineralcorticoid Metabolism
Corticotropin-releasing hormone
Phase 1 - Functionalization of compoundsWP702:Metapathway biotransformation
Tryptophan metabolism
Ovarian Infertility Genes
FSH signaling pathway
Integrated Breast Cancer Pathway
Phase 1 - Functionalization of compounds
References
Ref 533478J Med Chem. 1986 Aug;29(8):1362-9.Aromatase inhibitors. Synthesis and evaluation of mammary tumor inhibiting activity of 3-alkylated 3-(4-aminophenyl)piperidine-2,6-diones.
Ref 533478J Med Chem. 1986 Aug;29(8):1362-9.Aromatase inhibitors. Synthesis and evaluation of mammary tumor inhibiting activity of 3-alkylated 3-(4-aminophenyl)piperidine-2,6-diones.

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