| Drug General Information |
| Drug ID |
D07IQG
|
| Former ID |
DNC004437
|
| Drug Name |
4-Bromo-1-imidazol-1-ylmethyl-xanthen-9-one
|
| Drug Type |
Small molecular drug
|
| Indication |
Discovery agent
|
Investigative |
[1]
|
|---|
| Structure |
|
Download
2D MOL
3D MOL
|
| Formula |
C17H11BrN2O2
|
| Canonical SMILES |
C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3O2)Br)CN4C=CN=C4
|
| InChI |
1S/C17H11BrN2O2/c18-13-6-5-11(9-20-8-7-19-10-20)15-16(21)12-3-1-2-4-14(12)22-17(13)15/h1-8,10H,9H2
|
| InChIKey |
FSWPWGQUEZXZFV-UHFFFAOYSA-N
|
| PubChem Compound ID |
|
| Target and Pathway |
| Target(s) |
Cytochrome P450 19 |
Target Info |
Inhibitor |
[1]
|
|---|
| 17 alpha-hydroxylase-C17, 20-lyase |
Target Info |
Inhibitor |
[1]
|
|
BioCyc Pathway
|
Superpathway of steroid hormone biosynthesis
|
|
Estradiol biosynthesis II
|
|
Estradiol biosynthesis IPWY-7305:Superpathway of steroid hormone biosynthesis
|
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Glucocorticoid biosynthesis
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Androgen biosynthesis
|
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KEGG Pathway
|
Steroid hormone biosynthesis
|
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Metabolic pathways
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Ovarian steroidogenesishsa00140:Steroid hormone biosynthesis
|
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Ovarian steroidogenesis
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Prolactin signaling pathway
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NetPath Pathway
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FSH Signaling Pathway
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PANTHER Pathway
|
Androgen/estrogene/progesterone biosynthesis
|
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PathWhiz Pathway
|
Androgen and Estrogen MetabolismPW000045:Androgen and Estrogen Metabolism
|
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Steroidogenesis
|
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Reactome
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Endogenous sterolsR-HSA-193048:Androgen biosynthesis
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Glucocorticoid biosynthesis
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Endogenous sterols
|
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WikiPathways
|
Metapathway biotransformation
|
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Tryptophan metabolism
|
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Oxidation by Cytochrome P450
|
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Ovarian Infertility Genes
|
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Metabolism of steroid hormones and vitamin D
|
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FSH signaling pathway
|
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Integrated Breast Cancer Pathway
|
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Phase 1 - Functionalization of compoundsWP702:Metapathway biotransformation
|
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Steroid Biosynthesis
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Glucocorticoid & Mineralcorticoid Metabolism
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Prostate Cancer
|
|
Phase 1 - Functionalization of compounds
|
| References |
| REF 1 | A new class of nonsteroidal aromatase inhibitors: design and synthesis of chromone and xanthone derivatives and inhibition of the P450 enzymes aromatase and 17 alpha-hydroxylase/C17,20-lyase. J Med Chem. 2001 Mar 1;44(5):672-80. |
|---|
