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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phosphodiesterase 3' and Ligand = 'BDBM50229947'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Phosphodiesterase 3


(Homo sapiens (Human))
BDBM50229947
PNG
(CHEMBL49527)
Show SMILES CN1C(=O)C[S+]([O-])c2cc(ccc12)C1=NNC(=O)CC1
Show InChI InChI=1/C13H13N3O3S/c1-16-10-4-2-8(9-3-5-12(17)15-14-9)6-11(10)20(19)7-13(16)18/h2,4,6H,3,5,7H2,1H3,(H,15,17)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.50E+4n/an/an/an/an/an/a



R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of canine cardiac Phosphodiesterase 3


J Med Chem 35: 172-6 (1992)


Article DOI: 10.1021/jm00079a023
BindingDB Entry DOI: 10.7270/Q2NS0X4D
More data for this
Ligand-Target Pair