Chemical Component Summary

Name1-methyl-8-(phenylamino)-4,5-dihydro-1H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid
Identifiers1-methyl-8-phenylazanyl-4,5-dihydropyrimido[5,4-g]indazole-3-carboxylic acid
FormulaC17 H15 N5 O2
Molecular Weight321.333
TypeNON-POLYMER
Isomeric SMILESCn1c-2c(c(n1)C(=O)O)CCc3c2nc(nc3)Nc4ccccc4
InChIInChI=1S/C17H15N5O2/c1-22-15-12(14(21-22)16(23)24)8-7-10-9-18-17(20-13(10)15)19-11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3,(H,23,24)(H,18,19,20)
InChIKeyZOBRPBVIEUWYJR-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count39
Chiral Atom Count0
Bond Count42
Aromatic Bond Count18

Drug Info: DrugBank

DrugBank IDDB08355 
Name1-methyl-8-(phenylamino)-4,5-dihydro-1H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid
Groups experimental
Synonyms1-methyl-8-(phenylamino)-4,5-dihydro-1H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid

Drug Targets

NameTarget SequencePharmacological ActionActions
Cyclin-A2MLGNSAPGPATREAGSALLALQQTALQEDQENINPEKAAPVQQPRTRAAL...unknown
Cyclin-dependent kinase 2MENFQKVEKIGEGTYGVVYKARNKLTGEVVALKKIRLDTETEGVPSTAIR...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
Pharos CHEMBL1098060
PubChem 44129603
ChEMBL CHEMBL1098060