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 = 'BDBM50474162'   

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))	BDBM50474162 (CHEMBL59953) Show SMILES COc1ccc(cc1OC)C1=NN(CC(=O)Nc2ccc(cc2)-c2ccc(O)nn2)C(=O)C2CC=CCC12 |c:37,t:11| Show InChI InChI=1S/C28H27N5O5/c1-37-23-13-9-18(15-24(23)38-2)27-20-5-3-4-6-21(20)28(36)33(32-27)16-26(35)29-19-10-7-17(8-11-19)22-12-14-25(34)31-30-22/h3-4,7-15,20-21H,5-6,16H2,1-2H3,(H,29,35)(H,31,34)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.90	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Curated by ChEMBL					Assay Description inhibition of cAMP-specific phosphodiesterase 4 (PDE4) was determined in cytosol from human neutrophils				J Med Chem 46: 2008-16 (2003) Article DOI: 10.1021/jm030776l BindingDB Entry DOI: 10.7270/Q2S1857B
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