Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D' and Ligand = 'BDBM50216265'   

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))	BDBM50216265 (CHEMBL91526) Show SMILES CCCN(Cc1ccc(cc1)C(=O)NC)S(=O)(=O)c1ccc(OC)c(OC)c1 Show InChI InChI=1S/C20H26N2O5S/c1-5-12-22(14-15-6-8-16(9-7-15)20(23)21-2)28(24,25)17-10-11-18(26-3)19(13-17)27-4/h6-11,13H,5,12,14H2,1-4H3,(H,21,23)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chiroscience Ltd Curated by ChEMBL					Assay Description In vitro binding activity towards catalytic site of phosphodiesterase 4				Bioorg Med Chem Lett 8: 2635-40 (1999) BindingDB Entry DOI: 10.7270/Q2MP52FN
					More data for this Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D (Homo sapiens (Human))	BDBM50216265 (CHEMBL91526) Show SMILES CCCN(Cc1ccc(cc1)C(=O)NC)S(=O)(=O)c1ccc(OC)c(OC)c1 Show InChI InChI=1S/C20H26N2O5S/c1-5-12-22(14-15-6-8-16(9-7-15)20(23)21-2)28(24,25)17-10-11-18(26-3)19(13-17)27-4/h6-11,13H,5,12,14H2,1-4H3,(H,21,23)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	4.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chiroscience Ltd Curated by ChEMBL					Assay Description Binding activity towards Rolipram binding site of phosphodiesterase 4				Bioorg Med Chem Lett 8: 2635-40 (1999) BindingDB Entry DOI: 10.7270/Q2MP52FN
					More data for this Ligand-Target Pair