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BDBM50050581 1,3-Dimethyl-6-(2-propoxy-5-thiophen-2-yl-phenyl)-1,5-dihydro-pyrazolo[3,4-d]pyrimidin-4-one::CHEMBL289344

SMILES: CCCOc1ccc(cc1-c1nc2n(C)nc(C)c2c(=O)[nH]1)-c1cccs1

InChI Key: InChIKey=DJDGIMIMAXMVTM-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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

Found 2 hits for monomerid = 50050581   
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
Phosphodiesterase 5A


(Rattus norvegicus)
BDBM50050581
PNG
(1,3-Dimethyl-6-(2-propoxy-5-thiophen-2-yl-phenyl)-...)
Show SMILES CCCOc1ccc(cc1-c1nc2n(C)nc(C)c2c(=O)[nH]1)-c1cccs1
Show InChI InChI=1S/C20H20N4O2S/c1-4-9-26-15-8-7-13(16-6-5-10-27-16)11-14(15)18-21-19-17(20(25)22-18)12(2)23-24(19)3/h5-8,10-11H,4,9H2,1-3H3,(H,21,22,25)
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MMDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 300n/an/an/an/a



Laboratories Glaxo Wellcome Centre de Recherches

Curated by ChEMBL


Assay Description
Compound was tested for inhibition of stimulation of rat aortic smooth muscle cells (RSMC)


J Med Chem 39: 1635-44 (1996)


Article DOI: 10.1021/jm950812j
BindingDB Entry DOI: 10.7270/Q2057F1T
More data for this
Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))
BDBM50050581
PNG
(1,3-Dimethyl-6-(2-propoxy-5-thiophen-2-yl-phenyl)-...)
Show SMILES CCCOc1ccc(cc1-c1nc2n(C)nc(C)c2c(=O)[nH]1)-c1cccs1
Show InChI InChI=1S/C20H20N4O2S/c1-4-9-26-15-8-7-13(16-6-5-10-27-16)11-14(15)18-21-19-17(20(25)22-18)12(2)23-24(19)3/h5-8,10-11H,4,9H2,1-3H3,(H,21,22,25)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Laboratories Glaxo Wellcome Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of Phosphodiesterase 5 from human


J Med Chem 39: 1635-44 (1996)


Article DOI: 10.1021/jm950812j
BindingDB Entry DOI: 10.7270/Q2057F1T
More data for this
Ligand-Target Pair