BDBM50263790 CHEMBL4103493

SMILES: Cc1nc(-c2c(nn(C)c2-c2ccc(c(C)c2)C(F)(F)F)C(O)=O)n2nc(C)[nH]c(=O)c12

InChI Key: InChIKey=CXRKTVIUTWDWGM-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50263790   

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
Homo sapiens phosphodiesterase 2A (PDE2A) (Homo sapiens (Human))	BDBM50263790 (CHEMBL4103493) Show SMILES Cc1nc(-c2c(nn(C)c2-c2ccc(c(C)c2)C(F)(F)F)C(O)=O)n2nc(C)[nH]c(=O)c12 |(19.76,-6.04,;19.28,-7.5,;20.18,-8.75,;19.27,-9.99,;19.74,-11.45,;21.21,-11.94,;21.2,-13.47,;19.73,-13.94,;19.26,-15.41,;18.84,-12.69,;17.3,-12.7,;16.53,-11.36,;14.99,-11.36,;14.22,-12.68,;14.99,-14.02,;14.21,-15.35,;16.52,-14.02,;12.67,-12.67,;12.67,-14.21,;11.34,-13.43,;11.92,-11.35,;22.46,-11.03,;23.87,-11.66,;22.3,-9.49,;17.81,-9.51,;16.47,-10.28,;15.15,-9.5,;13.81,-10.27,;15.15,-7.96,;16.49,-7.2,;16.49,-5.66,;17.81,-7.97,)| Show InChI InChI=1S/C20H17F3N6O3/c1-8-7-11(5-6-12(8)20(21,22)23)16-13(14(19(31)32)27-28(16)4)17-24-9(2)15-18(30)25-10(3)26-29(15)17/h5-7H,1-4H3,(H,31,32)(H,25,26,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human PDE2A1 using 3',5'-[3H]cGMP as substrate after 30 mins by scintillation proximity assay				J Med Chem 61: 3626-3640 (2018) Article DOI: 10.1021/acs.jmedchem.8b00116 BindingDB Entry DOI: 10.7270/Q2BV7K2X
					More data for this Ligand-Target Pair