BDBM50266514 CHEMBL457331::N,N-dimethyl-4-(1-(4-(methylsulfonyl)phenyl)-1H-[1,2,3]triazol-5-yl)aniline

SMILES: CN(C)c1ccc(cc1)-c1cnnn1-c1ccc(cc1)S(C)(=O)=O

InChI Key: InChIKey=ZSGDYNVQAVIADC-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 = 50266514   

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 (Homo sapiens (Human))	BDBM50266514 (CHEMBL457331 | N,N-dimethyl-4-(1-(4-(methylsulfony...) Show SMILES CN(C)c1ccc(cc1)-c1cnnn1-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C17H18N4O2S/c1-20(2)14-6-4-13(5-7-14)17-12-18-19-21(17)15-8-10-16(11-9-15)24(3,22)23/h4-12H,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
University of Alberta Curated by ChEMBL					Assay Description Inhibition of COX2 by enzyme immunoassay				Bioorg Med Chem 17: 1146-51 (2009) Article DOI: 10.1016/j.bmc.2008.12.032 BindingDB Entry DOI: 10.7270/Q2HQ3ZSJ
					More data for this Ligand-Target Pair
Cyclooxygenase-1 (COX-1) (Homo sapiens (Human))	BDBM50266514 (CHEMBL457331 | N,N-dimethyl-4-(1-(4-(methylsulfony...) Show SMILES CN(C)c1ccc(cc1)-c1cnnn1-c1ccc(cc1)S(C)(=O)=O Show InChI InChI=1S/C17H18N4O2S/c1-20(2)14-6-4-13(5-7-14)17-12-18-19-21(17)15-8-10-16(11-9-15)24(3,22)23/h4-12H,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
University of Alberta Curated by ChEMBL					Assay Description Inhibition of COX1 by enzyme immunoassay				Bioorg Med Chem 17: 1146-51 (2009) Article DOI: 10.1016/j.bmc.2008.12.032 BindingDB Entry DOI: 10.7270/Q2HQ3ZSJ
					More data for this Ligand-Target Pair