BDBM50237917 CHEMBL4059741

SMILES: CCS(=O)(=O)Oc1ccc2c(C)c(C#N)c(=O)oc2c1

InChI Key: InChIKey=PDSMYLQMNURHPO-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 = 50237917   

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
Intestinal alkaline phosphatase (Homo sapiens (Human))	BDBM50237917 (CHEMBL4059741) Show SMILES CCS(=O)(=O)Oc1ccc2c(C)c(C#N)c(=O)oc2c1 Show InChI InChI=1S/C13H11NO5S/c1-3-20(16,17)19-9-4-5-10-8(2)11(7-14)13(15)18-12(10)6-9/h4-6H,3H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Ability to block progesterone induced alkaline phosphatase activity in T47D human breast cancer cell line				Eur J Med Chem 131: 29-47 (2017) Article DOI: 10.1016/j.ejmech.2017.03.003 BindingDB Entry DOI: 10.7270/Q2MS3W2X
					More data for this Ligand-Target Pair