Drug Information
| Drug General Information | Top | |||
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| Drug ID |
D03ATU
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| Former ID |
DNC004134
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| Drug Name |
PD-158780
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| Synonyms |
171179-06-9; PD158780; pd 158780; N4-(3-bromophenyl)-N6-methylpyrido[3,4-d]pyrimidine-4,6-diamine; AC1L1IRV; CHEMBL53753; PD 158780; 4-N-(3-bromophenyl)-6-N-methylpyrido[3,4-d]pyrimidine-4,6-diamine; AK160389; 4-(3-bromoanilino)-6-methylaminopyrido[3,4-d]pyrimidine; 4-[(3-bromophenyl)amino]-6-(methylamino)pyrido[3,4-d]pyrimidine; 4-[(3-Bromophenyl)amino]-6-(methylamino)-pyrido[3,4-d]pyridimine; Pyrido[3,4-d]pyrimidine-4,6-diamine, N4-(3-bromophenyl)-N6-methyl-
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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 |
C14H12BrN5
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| Canonical SMILES |
CNC1=NC=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)Br
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| InChI |
1S/C14H12BrN5/c1-16-13-6-11-12(7-17-13)18-8-19-14(11)20-10-4-2-3-9(15)5-10/h2-8H,1H3,(H,16,17)(H,18,19,20)
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| InChIKey |
KFHMLBXBRCITHF-UHFFFAOYSA-N
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| CAS Number |
CAS 171179-06-9
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| PubChem Compound ID | ||||
| PubChem Substance ID |
7799418, 8033324, 8152889, 14826626, 26759326, 26759327, 29223793, 50112934, 50274261, 53788011, 53800604, 53800605, 57322409, 87685840, 99302733, 103097906, 103238181, 104307192, 117389548, 126407975, 128374071, 134341339, 134964498, 135698224, 139404189, 162023449, 162248899, 163687525, 163687526, 175607421, 177748577, 178102637, 179148748, 208264825, 223587258, 223699533, 223741627, 225373244, 227489881, 241376032, 242076205, 249867850, 250223331, 252063983, 252138617, 252156655, 252268044, 252316220, 252433433, 252480411
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| ChEBI ID |
CHEBI:92843
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| References | Top | |||
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| REF 1 | URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 6015). | |||
| REF 2 | Tyrosine kinase inhibitors. 10. Isomeric 4-[(3-bromophenyl)amino]pyrido[d]-pyrimidines are potent ATP binding site inhibitors of the tyrosine kinas... J Med Chem. 1996 Apr 26;39(9):1823-35. | |||
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