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 = 'BDBM50474164'   

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))	BDBM50474164 (CHEMBL304715) Show SMILES CCOc1ccc(cc1OCC)C1=NN(CCCCOc2ccc(cc2)C2=NNC(=O)CC2C)C(=O)C2CC=CCC12 |c:41,t:13,28| Show InChI InChI=1S/C33H40N4O5/c1-4-40-28-17-14-24(21-29(28)41-5-2)32-26-10-6-7-11-27(26)33(39)37(36-32)18-8-9-19-42-25-15-12-23(13-16-25)31-22(3)20-30(38)34-35-31/h6-7,12-17,21-22,26-27H,4-5,8-11,18-20H2,1-3H3,(H,34,38)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.5	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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