BDBM50381304 CHEMBL2019117

SMILES: CNC(=O)c1ccc(c(OC)c1)-c1nc2snc(C3CCCCC3)c2c(=O)[nH]1

InChI Key: InChIKey=HSBHEXHEGBSASH-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 = 50381304   

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
Phosphodiesterase 7 (Homo sapiens (Human))	BDBM50381304 (CHEMBL2019117) Show SMILES CNC(=O)c1ccc(c(OC)c1)-c1nc2snc(C3CCCCC3)c2c(=O)[nH]1 Show InChI InChI=1S/C20H22N4O3S/c1-21-18(25)12-8-9-13(14(10-12)27-2)17-22-19(26)15-16(24-28-20(15)23-17)11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H,21,25)(H,22,23,26)	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	125	n/a	n/a	n/a	n/a	n/a	n/a
Glenmark Pharmaceuticals Limited Curated by ChEMBL					Assay Description Displacement of [3H]-cAMP from human recombinant PDE7A				Bioorg Med Chem Lett 22: 3223-8 (2012) Article DOI: 10.1016/j.bmcl.2012.03.025 BindingDB Entry DOI: 10.7270/Q2NP25F2
					More data for this Ligand-Target Pair