BDBM50050620 CHEMBL46771::N-[3-(1,3-Dimethyl-4-oxo-4,5-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxy-phenyl]-4-fluoro-benzamide

SMILES: CCCOc1ccc(NC(=O)c2ccc(F)cc2)cc1-c1nc2n(C)nc(C)c2c(=O)[nH]1

InChI Key: InChIKey=QPQPXIKPYOKODI-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 = 50050620   

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
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50050620 (CHEMBL46771 | N-[3-(1,3-Dimethyl-4-oxo-4,5-dihydro...) Show SMILES CCCOc1ccc(NC(=O)c2ccc(F)cc2)cc1-c1nc2n(C)nc(C)c2c(=O)[nH]1 Show InChI InChI=1S/C23H22FN5O3/c1-4-11-32-18-10-9-16(25-22(30)14-5-7-15(24)8-6-14)12-17(18)20-26-21-19(23(31)27-20)13(2)28-29(21)3/h5-10,12H,4,11H2,1-3H3,(H,25,30)(H,26,27,31)	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	2	n/a	n/a	n/a	n/a	n/a	n/a
Laboratories Glaxo Wellcome Centre de Recherches Curated by ChEMBL					Assay Description Inhibition of Phosphodiesterase 5 from human				J Med Chem 39: 1635-44 (1996) Article DOI: 10.1021/jm950812j BindingDB Entry DOI: 10.7270/Q2057F1T
					More data for this Ligand-Target Pair