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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-dependent 3',5'-cyclic phosphodiesterase' and Ligand = 'BDBM50263802'   
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
cGMP-dependent 3',5'-cyclic phosphodiesterase


(Homo sapiens (Human))		BDBM50263802
PNG
(CHEMBL4096035)
Show SMILES COc1ccc(Cc2nn3c(nc(C)c3c(=O)[nH]2)[C@@H](CCC(O)c2ccccc2)[C@@H](C)O)cc1O |r|
Show InChI InChI=1S/C26H30N4O5/c1-15-24-26(34)28-23(14-17-9-12-22(35-3)21(33)13-17)29-30(24)25(27-15)19(16(2)31)10-11-20(32)18-7-5-4-6-8-18/h4-9,12-13,16,19-20,31-33H,10-11,14H2,1-3H3,(H,28,29,34)/t16-,19+,20?/m1/s1
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Similars
Article
PubMed
n/an/a 3.60n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of human PDE2A1 using 3',5'-[3H]cGMP as substrate after 30 mins by scintillation proximity assay

J Med Chem 61: 3626-3640 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00116
BindingDB Entry DOI: 10.7270/Q2BV7K2X
More data for this
Ligand-Target Pair