BDBM50375323 CHEMBL409288

SMILES: CC1=CC(OC(=O)N1c1ccccc1)=c1c(=C)[nH]n(-c2ccccc2)c1=O

InChI Key: InChIKey=KLURZBCPQHRHJX-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 = 50375323   

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
Cyclooxygenase-1 (COX-1) (Homo sapiens (Human))	BDBM50375323 (CHEMBL409288) Show SMILES CC1=CC(OC(=O)N1c1ccccc1)=c1c(=C)[nH]n(-c2ccccc2)c1=O |w:3.2,t:1| Show InChI InChI=1S/C21H17N3O3/c1-14-13-18(27-21(26)23(14)16-9-5-3-6-10-16)19-15(2)22-24(20(19)25)17-11-7-4-8-12-17/h3-13,22H,2H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Sciences and Technology Houari Boum£di£ne Curated by ChEMBL					Assay Description Inhibition of COX1				Bioorg Med Chem 16: 3059-66 (2008) Article DOI: 10.1016/j.bmc.2007.12.033 BindingDB Entry DOI: 10.7270/Q251402X
					More data for this Ligand-Target Pair