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 = 'BDBM50229790'   

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))	BDBM50229790 (CHEMBL329573) Show SMILES Oc1nc2cc3cc(OCCCC(=O)N4CCN(CC5CCCCO5)CC4)ccc3[nH]c2n1 Show InChI InChI=1S/C24H31N5O4/c30-22(29-10-8-28(9-11-29)16-19-4-1-2-12-33-19)5-3-13-32-18-6-7-20-17(14-18)15-21-23(25-20)27-24(31)26-21/h6-7,14-15,19H,1-5,8-13,16H2,(H2,25,26,27,31)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	0.700	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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