NPZ

1-methyl-3-naphthalen-2-yl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Created:	2008-09-30
Last modified:	2011-06-04

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1 entries where NPZ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	0
Bond Count	37
Aromatic Bond Count	22

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Chemical Component Summary
Name	1-methyl-3-naphthalen-2-yl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Systematic Name (OpenEye OEToolkits)	1-methyl-3-naphthalen-2-yl-pyrazolo[4,5-e]pyrimidin-4-amine
Formula	C₁₆ H₁₃ N₅
Molecular Weight	275.308
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	n1c(c2c(nc1)n(nc2c4cc3ccccc3cc4)C)N
SMILES	CACTVS	3.341	Cn1nc(c2ccc3ccccc3c2)c4c(N)ncnc14
SMILES	OpenEye OEToolkits	1.5.0	Cn1c2c(c(n1)c3ccc4ccccc4c3)c(ncn2)N
Canonical SMILES	CACTVS	3.341	Cn1nc(c2ccc3ccccc3c2)c4c(N)ncnc14
Canonical SMILES	OpenEye OEToolkits	1.5.0	Cn1c2c(c(n1)c3ccc4ccccc4c3)c(ncn2)N
InChI	InChI	1.03	InChI=1S/C16H13N5/c1-21-16-13(15(17)18-9-19-16)14(20-21)12-7-6-10-4-2-3-5-11(10)8-12/h2-9H,1H3,(H2,17,18,19)
InChIKey	InChI	1.03	UOKGZPYGRJDACN-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB08300
Name	1-methyl-3-naphthalen-2-yl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Groups	experimental
Synonyms	1-methyl-3-naphthalen-2-yl-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform	MELENYKQPVVLREDNCRRRRRMKPRSAAASLSSMELIPIEFVLPTSQRK...	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