BDBM234781 US9353104, 76

SMILES: COc1ccc(nc1)[C@H]1C[C@@H]1COc1cc(NCc2ccc(C)nn2)c(=O)n(C)n1

InChI Key: InChIKey=JYOGDITUQNQIEE-PBHICJAKSA-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 = 234781   

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 (PDE10A2) (Homo sapiens (Human))	BDBM234781 (US9353104, 76) Show SMILES COc1ccc(nc1)[C@H]1C[C@@H]1COc1cc(NCc2ccc(C)nn2)c(=O)n(C)n1 |r| Show InChI InChI=1S/C21H24N6O3/c1-13-4-5-15(25-24-13)10-22-19-9-20(26-27(2)21(19)28)30-12-14-8-17(14)18-7-6-16(29-3)11-23-18/h4-7,9,11,14,17,22H,8,10,12H2,1-3H3/t14-,17+/m1/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.0390	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description The fluorescence polarization assay for cyclic nucleotide phosphodiesterases was performed using an IMAP® FP kit supplied by Molecular Devices, Sunny...				US Patent US9353104 (2016) BindingDB Entry DOI: 10.7270/Q2ZP4517
					More data for this Ligand-Target Pair