BDBM93106 COX inhibitor, 9

SMILES: CC1SC(N(Cc2ccccc2)C1=O)c1ccccc1

InChI Key: InChIKey=XCLUQWGMVIXYIU-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 = 93106   

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))	BDBM93106 (COX inhibitor, 9) Show SMILES CC1SC(N(Cc2ccccc2)C1=O)c1ccccc1 Show InChI InChI=1S/C17H17NOS/c1-13-16(19)18(12-14-8-4-2-5-9-14)17(20-13)15-10-6-3-7-11-15/h2-11,13,17H,12H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars		n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
Shahid Beheshti University					Assay Description The ability of the test compounds to inhibit ovine COX-1 and COX-2 was determined using chemiluminescent enzyme assays kit according to our previousl...				Med Chem Res 19: 782-793 (2009) BindingDB Entry DOI: 10.7270/Q2T72G2X
					More data for this Ligand-Target Pair
Cyclooxygenase (Homo sapiens (Human))	BDBM93106 (COX inhibitor, 9) Show SMILES CC1SC(N(Cc2ccccc2)C1=O)c1ccccc1 Show InChI InChI=1S/C17H17NOS/c1-13-16(19)18(12-14-8-4-2-5-9-14)17(20-13)15-10-6-3-7-11-15/h2-11,13,17H,12H2,1H3	MMDB Reactome pathway B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars		n/a	n/a	7.56E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shahid Beheshti University					Assay Description The ability of the test compounds to inhibit ovine COX-1 and COX-2 was determined using chemiluminescent enzyme assays kit according to our previousl...				Med Chem Res 19: 782-793 (2009) BindingDB Entry DOI: 10.7270/Q2T72G2X
					More data for this Ligand-Target Pair