BindingDB logo
myBDB logout

BDBM50050614 1-Ethyl-3-methyl-6-[5-(2-phenyl-thiazol-4-yl)-2-propoxy-phenyl]-1,5-dihydro-pyrazolo[3,4-d]pyrimidin-4-one::CHEMBL297763

SMILES: CCCOc1ccc(cc1-c1nc2n(CC)nc(C)c2c(=O)[nH]1)-c1csc(n1)-c1ccccc1

InChI Key: InChIKey=IHAPKVAVVGGFNM-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50050614   
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)
BDBM50050614
PNG
(1-Ethyl-3-methyl-6-[5-(2-phenyl-thiazol-4-yl)-2-pr...)
Show SMILES CCCOc1ccc(cc1-c1nc2n(CC)nc(C)c2c(=O)[nH]1)-c1csc(n1)-c1ccccc1
Show InChI InChI=1S/C26H25N5O2S/c1-4-13-33-21-12-11-18(20-15-34-26(27-20)17-9-7-6-8-10-17)14-19(21)23-28-24-22(25(32)29-23)16(3)30-31(24)5-2/h6-12,14-15H,4-5,13H2,1-3H3,(H,28,29,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 200n/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))
BDBM50050614
PNG
(1-Ethyl-3-methyl-6-[5-(2-phenyl-thiazol-4-yl)-2-pr...)
Show SMILES CCCOc1ccc(cc1-c1nc2n(CC)nc(C)c2c(=O)[nH]1)-c1csc(n1)-c1ccccc1
Show InChI InChI=1S/C26H25N5O2S/c1-4-13-33-21-12-11-18(20-15-34-26(27-20)17-9-7-6-8-10-17)14-19(21)23-28-24-22(25(32)29-23)16(3)30-31(24)5-2/h6-12,14-15H,4-5,13H2,1-3H3,(H,28,29,32)
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 3n/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