BDBM50362049 CHEMBL1940059

SMILES: Cc1n[nH]c2nc3c(C)cc(OC(F)(F)F)cc3c(CN3CCCOCC3)c12

InChI Key: InChIKey=PAXNYXPPEYOVCJ-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50362049   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50362049 (CHEMBL1940059) Show SMILES Cc1n[nH]c2nc3c(C)cc(OC(F)(F)F)cc3c(CN3CCCOCC3)c12 Show InChI InChI=1S/C19H21F3N4O2/c1-11-8-13(28-19(20,21)22)9-14-15(10-26-4-3-6-27-7-5-26)16-12(2)24-25-18(16)23-17(11)14/h8-9H,3-7,10H2,1-2H3,(H,23,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]cAMP from human recombinant PDE10A1 by competitive binding assay				Bioorg Med Chem Lett 22: 235-9 (2011) Article DOI: 10.1016/j.bmcl.2011.11.023 BindingDB Entry DOI: 10.7270/Q2862GWC
					More data for this Ligand-Target Pair