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BDBM50207131 3-(cyclopropylmethyl)-8-((6,7-dimethoxyisoquinolin-4-yl)methyl)-1-methyl-1H-purine-2,6(3H,7H)-dione::CHEMBL430199

SMILES: COc1cc2cncc(Cc3nc4n(CC5CC5)c(=O)n(C)c(=O)c4[nH]3)c2cc1OC

InChI Key: InChIKey=VQQYSIDQMSDJSG-UHFFFAOYSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50207131   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50207131
PNG
(3-(cyclopropylmethyl)-8-((6,7-dimethoxyisoquinolin...)
Show SMILES COc1cc2cncc(Cc3nc4n(CC5CC5)c(=O)n(C)c(=O)c4[nH]3)c2cc1OC
Show InChI InChI=1S/C22H23N5O4/c1-26-21(28)19-20(27(22(26)29)11-12-4-5-12)25-18(24-19)7-14-10-23-9-13-6-16(30-2)17(31-3)8-15(13)14/h6,8-10,12H,4-5,7,11H2,1-3H3,(H,24,25)
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MMDB

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Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Novartis Institutes of Biomedical Research

Curated by ChEMBL


Assay Description
Inhibition of human platelet PDE5 by [3H]cGMP scintillation proximity assay


Bioorg Med Chem Lett 17: 2376-9 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.019
BindingDB Entry DOI: 10.7270/Q2X63NSC
More data for this
Ligand-Target Pair