BDBM171879 US9085584, 45

SMILES: Cc1nc2ccc(nc2n2c(nnc12)-c1cc(OCC(C)(C)O)ccc1Cl)C1CC1

InChI Key: InChIKey=PRNVSRNXZYPTIN-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 = 171879   

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))	BDBM171879 (US9085584, 45) Show SMILES Cc1nc2ccc(nc2n2c(nnc12)-c1cc(OCC(C)(C)O)ccc1Cl)C1CC1 Show InChI InChI=1S/C22H22ClN5O2/c1-12-19-26-27-20(15-10-14(6-7-16(15)23)30-11-22(2,3)29)28(19)21-18(24-12)9-8-17(25-21)13-4-5-13/h6-10,13,29H,4-5,11H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.49E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description The inhibition of PDE 2A or 10 enzyme activity was assessed using IMAP-Phosphodiesterase-cAMP fluorescence labeled substrate (Molecular Devices, Orde...				US Patent US9085584 (2015) BindingDB Entry DOI: 10.7270/Q27P8X54
					More data for this Ligand-Target Pair
Homo sapiens phosphodiesterase 2A (PDE2A) (Homo sapiens (Human))	BDBM171879 (US9085584, 45) Show SMILES Cc1nc2ccc(nc2n2c(nnc12)-c1cc(OCC(C)(C)O)ccc1Cl)C1CC1 Show InChI InChI=1S/C22H22ClN5O2/c1-12-19-26-27-20(15-10-14(6-7-16(15)23)30-11-22(2,3)29)28(19)21-18(24-12)9-8-17(25-21)13-4-5-13/h6-10,13,29H,4-5,11H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description The inhibition of PDE 2A or 10 enzyme activity was assessed using IMAP-Phosphodiesterase-cAMP fluorescence labeled substrate (Molecular Devices, Orde...				US Patent US9085584 (2015) BindingDB Entry DOI: 10.7270/Q27P8X54
					More data for this Ligand-Target Pair