BDBM171902 US9085584, 61

SMILES: CCCC(O)c1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(C)nc3n12

InChI Key: InChIKey=NBSFRDYQPJRINF-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 = 171902   

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))	BDBM171902 (US9085584, 61) Show SMILES CCCC(O)c1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(C)nc3n12 Show InChI InChI=1S/C20H20ClN5O/c1-4-5-17(27)13-7-8-15(21)14(10-13)19-25-24-18-12(3)23-16-9-6-11(2)22-20(16)26(18)19/h6-10,17,27H,4-5H2,1-3H3	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	534	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))	BDBM171902 (US9085584, 61) Show SMILES CCCC(O)c1ccc(Cl)c(c1)-c1nnc2c(C)nc3ccc(C)nc3n12 Show InChI InChI=1S/C20H20ClN5O/c1-4-5-17(27)13-7-8-15(21)14(10-13)19-25-24-18-12(3)23-16-9-6-11(2)22-20(16)26(18)19/h6-10,17,27H,4-5H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4	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