Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A' and Ligand = 'BDBM50357879'   

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 and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A (Homo sapiens (Human))	BDBM50357879 (CHEMBL1916139) Show SMILES COc1cc(F)c2nc(C)c3c(C)nc(-c4c(C)nn(C)c4C)n3c2c1 |(31.55,-41.35,;32.88,-42.12,;34.22,-41.35,;34.22,-39.81,;35.55,-39.04,;35.54,-37.5,;36.88,-39.8,;38.22,-39.02,;39.56,-39.8,;40.89,-39.04,;39.55,-41.35,;40.7,-42.39,;42.21,-42.07,;40.06,-43.8,;38.53,-43.63,;37.58,-44.84,;38,-46.32,;39.45,-46.85,;36.72,-47.18,;35.51,-46.23,;34.03,-46.65,;36.04,-44.78,;35.19,-43.5,;38.21,-42.12,;36.88,-41.35,;35.55,-42.12,)| Show InChI InChI=1S/C19H20FN5O/c1-9-16(12(4)24(5)23-9)19-22-11(3)18-10(2)21-17-14(20)7-13(26-6)8-15(17)25(18)19/h7-8H,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of N-terminal His-tagged human PDE10A expressed in Escherichia coli using [3H]cAMP after 1 hr by scintillation proximity assay				J Med Chem 54: 7621-38 (2011) Article DOI: 10.1021/jm2009138 BindingDB Entry DOI: 10.7270/Q2125T2B
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