Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cAMP-specific 3',5'-cyclic phosphodiesterase 4B' and Ligand = 'BDBM50017329'   

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 4B (Homo sapiens (Human))	BDBM50017329 (CHEMBL3288018) Show SMILES CN(C)Cc1ccc(cc1)-c1cccc(Oc2ncc(F)cc2C(=O)N[C@@H]2CC[C@@H](CC2)NC(=O)c2cn3c(C)cccc3n2)c1 |r,wU:29.34,26.27,(15.65,-19.05,;16.97,-18.28,;18.3,-19.05,;16.96,-16.75,;15.63,-15.99,;14.3,-16.76,;12.96,-16,;12.96,-14.46,;14.28,-13.68,;15.62,-14.44,;11.62,-13.7,;10.29,-14.48,;8.95,-13.71,;8.95,-12.17,;10.29,-11.41,;10.28,-9.87,;8.95,-9.09,;7.61,-9.87,;6.27,-9.09,;6.27,-7.55,;4.94,-6.78,;7.61,-6.78,;8.94,-7.54,;10.27,-6.77,;10.27,-5.23,;11.61,-7.53,;12.94,-6.76,;14.28,-7.53,;15.61,-6.77,;15.61,-5.23,;14.27,-4.45,;12.94,-5.23,;16.95,-4.45,;18.28,-5.23,;18.28,-6.77,;19.5,-4.28,;19.45,-2.76,;20.9,-2.23,;21.48,-.81,;20.54,.4,;23.01,-.6,;23.96,-1.83,;23.37,-3.26,;21.84,-3.46,;20.98,-4.72,;11.62,-12.16,)| Show InChI InChI=1S/C36H37FN6O3/c1-23-6-4-9-33-41-32(22-43(23)33)35(45)40-29-16-14-28(15-17-29)39-34(44)31-19-27(37)20-38-36(31)46-30-8-5-7-26(18-30)25-12-10-24(11-13-25)21-42(2)3/h4-13,18-20,22,28-29H,14-17,21H2,1-3H3,(H,39,44)(H,40,45)/t28-,29+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.794	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human recombinant PDE4B using [3H]cAMP by packard topcount scintillation counting analysis				J Med Chem 57: 4661-76 (2014) Article DOI: 10.1021/jm5001216 BindingDB Entry DOI: 10.7270/Q2708302
					More data for this Ligand-Target Pair