Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0R5WV
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| Former ID |
DNC009345
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| Drug Name |
3,3'-(1,2,4-Thiadiazol-2,5-diyl)diphenol
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| Synonyms |
3,3'-(1,3,4-Thiadiazole-2,5-diyl)diphenol; 155877-54-6; CHEMBL450189; SCHEMBL1180710; BDBM25837; CTK0E7552; DTXSID00618942; KZZBPNSRBQBVII-UHFFFAOYSA-N; hydroxyphenyl substituted thiadiazole, 9; 2,5-Bis(3-hydroxyphenyl)-1,3,4-thiadiazole; Phenol, 3,3'-(1,3,4-thiadiazole-2,5-diyl)bis-
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C14H10N2O2S
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| Canonical SMILES |
C1=CC(=CC(=C1)O)C2=NN=C(S2)C3=CC(=CC=C3)O
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| InChI |
1S/C14H10N2O2S/c17-11-5-1-3-9(7-11)13-15-16-14(19-13)10-4-2-6-12(18)8-10/h1-8,17-18H
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| InChIKey |
KZZBPNSRBQBVII-UHFFFAOYSA-N
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| CAS Number |
CAS 155877-54-6
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Estradiol 17 beta-dehydrogenase 1 (17-beta-HSD1) | Target Info | Inhibitor | [1] |
| BioCyc | Superpathway of steroid hormone biosynthesis | |||
| Estradiol biosynthesis I | ||||
| KEGG Pathway | Steroid hormone biosynthesis | |||
| Metabolic pathways | ||||
| Ovarian steroidogenesis | ||||
| NetPath Pathway | FSH Signaling Pathway | |||
| Panther Pathway | Androgen/estrogene/progesterone biosynthesis | |||
| Pathwhiz Pathway | Androgen and Estrogen Metabolism | |||
| Reactome | The canonical retinoid cycle in rods (twilight vision) | |||
| WikiPathways | Steroid Biosynthesis | |||
| Metabolism of steroid hormones and vitamin D | ||||
| Prostate Cancer | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Design, synthesis, biological evaluation and pharmacokinetics of bis(hydroxyphenyl) substituted azoles, thiophenes, benzenes, and aza-benzenes as p... J Med Chem. 2008 Nov 13;51(21):6725-39. | |||
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