Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D0A3MV
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| Former ID |
DNC009071
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| Drug Name |
AR-A014418
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| Synonyms |
487021-52-3; GSK-3beta Inhibitor VIII; 1-(4-methoxybenzyl)-3-(5-nitrothiazol-2-yl)urea; 1-[(4-methoxyphenyl)methyl]-3-(5-nitro-1,3-thiazol-2-yl)urea; A Inhibitor VIII; N-(4-METHOXYBENZYL)-N'-(5-NITRO-1,3-THIAZOL-2-YL)UREA; UNII-87KSH90Q6D; AR-AO 14418; SN 4521; AR-A 014418; CHEMBL259850; 87KSH90Q6D; N-[(4-Methoxyphenyl)methyl]-N'-(5-nitro-2-thiazolyl)urea; AK175829; C12H12N4O4S; N-(4-Methoxybenzyl)-N& -(5-nitro-1,3-thiazol-2-yl)urea; AR 014418; GSK 3be
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| Drug Type |
Small molecular drug
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| Indication | Ovarian cancer [ICD-11: 2C73; ICD-10: C56; ICD-9: 183] | Patented | [1] | |
| Structure |
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Download2D MOL |
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| Formula |
C12H12N4O4S
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| Canonical SMILES |
COC1=CC=C(C=C1)CNC(=O)NC2=NC=C(S2)[N+](=O)[O-]
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| InChI |
1S/C12H12N4O4S/c1-20-9-4-2-8(3-5-9)6-13-11(17)15-12-14-7-10(21-12)16(18)19/h2-5,7H,6H2,1H3,(H2,13,14,15,17)
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| InChIKey |
YAEMHJKFIIIULI-UHFFFAOYSA-N
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| CAS Number |
CAS 487021-52-3
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| PubChem Compound ID | ||||
| PubChem Substance ID |
583653, 7890811, 10300157, 14894299, 26758802, 26758810, 36890004, 46392950, 46507570, 47425346, 53800749, 53800756, 57404849, 77873456, 85787202, 92098484, 99029950, 99302715, 103567576, 103904634, 104098221, 104638850, 121379638, 134346276, 137220723, 139155023, 139155024, 142640836, 160965173, 161005183, 162166259, 163123798, 163688033, 163688041, 164045293, 164835932, 172912851, 174009352, 175607480, 178102602, 179230474, 185998788, 198988118, 204371600, 208264965, 208264972, 210274694, 210280328, 223370038, 223380339
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| References | Top | |||
|---|---|---|---|---|
| REF 1 | Glycogen synthase kinase 3 (GSK-3) inhibitors: a patent update (2014-2015).Expert Opin Ther Pat. 2017 Jun;27(6):657-666. | |||
| REF 2 | Fragment and knowledge-based design of selective GSK-3beta inhibitors using virtual screening models. Eur J Med Chem. 2009 Jun;44(6):2361-71. | |||
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