BDBM179972 US9669035, B-11

SMILES: CCCCOc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(CN(C)C)cc3n12

InChI Key: InChIKey=LFPMUKYZLLOJCK-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 179972   

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 (Rattus norvegicus (rat))	BDBM179972 (US9669035, B-11) Show SMILES CCCCOc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(CN(C)C)cc3n12 Show InChI InChI=1S/C23H26ClN5O/c1-5-6-11-30-17-8-9-19(24)18(13-17)23-27-26-22-15(2)25-20-10-7-16(14-28(3)4)12-21(20)29(22)23/h7-10,12-13H,5-6,11,14H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	7.8	25
JANSSEN PHARMACEUTICA NV US Patent					Assay Description Rat recombinant PDE10A (rPDE10A2) was expressed in Sf9 cells using a recombinant rPDE10A baculovirus construct. Cells were harvested after 48 h of in...				US Patent US9669035 (2017) BindingDB Entry DOI: 10.7270/Q2Z60M6H
					More data for this Ligand-Target Pair
cGMP-dependent 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM179972 (US9669035, B-11) Show SMILES CCCCOc1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(CN(C)C)cc3n12 Show InChI InChI=1S/C23H26ClN5O/c1-5-6-11-30-17-8-9-19(24)18(13-17)23-27-26-22-15(2)25-20-10-7-16(14-28(3)4)12-21(20)29(22)23/h7-10,12-13H,5-6,11,14H2,1-4H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	7.8	25
JANSSEN PHARMACEUTICA NV US Patent					Assay Description Human recombinant PDE2A (hPDE2A) was expressed in Sf9 cells using a recombinant rPDE10A baculovirus construct. Cells were harvested after 48 h of inf...				US Patent US9669035 (2017) BindingDB Entry DOI: 10.7270/Q2Z60M6H
					More data for this Ligand-Target Pair