Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A/3B' and Ligand = 'BDBM50229789'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
cGMP-inhibited 3',5'-cyclic phosphodiesterase 3A/3B (Homo sapiens (Human))	BDBM50229789 (CHEMBL327786) Show SMILES O=C(CCCOc1ccc2N=C3NC(=O)CN3Cc2c1)N1CCN(CC2CCCCC2)CC1 |t:10| Show InChI InChI=1S/C25H35N5O3/c31-23-18-30-17-20-15-21(8-9-22(20)26-25(30)27-23)33-14-4-7-24(32)29-12-10-28(11-13-29)16-19-5-2-1-3-6-19/h8-9,15,19H,1-7,10-14,16-18H2,(H,26,27,31)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem	PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of human platelet c-AMP phosphodiesterase PDE 3				J Med Chem 35: 2688-96 (1992) BindingDB Entry DOI: 10.7270/Q2PN97WB
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