Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D' and Ligand = 'BDBM50216296'   

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
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D (Homo sapiens (Human))	BDBM50216296 (CHEMBL89635) Show SMILES CCOc1cc(ccc1OC)C(CC(=O)OC)N1C(=O)c2c(C1=O)c(F)c(F)c(F)c2F Show InChI InChI=1S/C21H17F4NO6/c1-4-32-12-7-9(5-6-11(12)30-2)10(8-13(27)31-3)26-20(28)14-15(21(26)29)17(23)19(25)18(24)16(14)22/h5-7,10H,4,8H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Celgene Corporation Curated by ChEMBL					Assay Description Inhibition of phosphodiesterase 4 from U937 cells				Bioorg Med Chem Lett 8: 2669-74 (1998) BindingDB Entry DOI: 10.7270/Q2BK1FJH
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