BDBM50297812 6-(4-fluorophenyl)-4-(pyridin-2-ylmethyl)-2-((tetrahydro-2H-pyran-4-yl)methylamino)pyrido[2,3-b]pyrazin-3(4H)-one::CHEMBL562208

SMILES: Fc1ccc(cc1)-c1ccc2nc(NCC3CCOCC3)c(=O)n(Cc3ccccn3)c2n1

InChI Key: InChIKey=ZITXLUSHUFDGGV-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 = 50297812   

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
3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50297812 (6-(4-fluorophenyl)-4-(pyridin-2-ylmethyl)-2-((tetr...) Show SMILES Fc1ccc(cc1)-c1ccc2nc(NCC3CCOCC3)c(=O)n(Cc3ccccn3)c2n1 Show InChI InChI=1S/C25H24FN5O2/c26-19-6-4-18(5-7-19)21-8-9-22-24(30-21)31(16-20-3-1-2-12-27-20)25(32)23(29-22)28-15-17-10-13-33-14-11-17/h1-9,12,17H,10-11,13-16H2,(H,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of PDE5 (unknown origin)				Citation and Details Article DOI: 10.1007/s00044-010-9523-y BindingDB Entry DOI: 10.7270/Q2JW8HS3
					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50297812 (6-(4-fluorophenyl)-4-(pyridin-2-ylmethyl)-2-((tetr...) Show SMILES Fc1ccc(cc1)-c1ccc2nc(NCC3CCOCC3)c(=O)n(Cc3ccccn3)c2n1 Show InChI InChI=1S/C25H24FN5O2/c26-19-6-4-18(5-7-19)21-8-9-22-24(30-21)31(16-20-3-1-2-12-27-20)25(32)23(29-22)28-15-17-10-13-33-14-11-17/h1-9,12,17H,10-11,13-16H2,(H,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of PDE5				Bioorg Med Chem Lett 19: 4088-91 (2009) Article DOI: 10.1016/j.bmcl.2009.06.012 BindingDB Entry DOI: 10.7270/Q23R0SXR
					More data for this Ligand-Target Pair