BDBM128405 US8802695, 21

SMILES: CC(C)(O)c1ccc(cc1)C(=O)Nc1cc2n(CS(C)(=O)=O)ccc2cn1

InChI Key: InChIKey=WXHTYSQXKXPROS-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 = 128405   

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
Mitogen-activated protein kinase kinase kinase 5 (MAP3K5) (Homo sapiens (Human))	BDBM128405 (US8802695, 21) Show SMILES CC(C)(O)c1ccc(cc1)C(=O)Nc1cc2n(CS(C)(=O)=O)ccc2cn1 Show InChI InChI=1S/C19H21N3O4S/c1-19(2,24)15-6-4-13(5-7-15)18(23)21-17-10-16-14(11-20-17)8-9-22(16)12-27(3,25)26/h4-11,24H,12H2,1-3H3,(H,20,21,23)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.24E+4	n/a	n/a	n/a	n/a	7.3	25
Takeda Pharmaceutical Company Limited US Patent					Assay Description The inhibitory properties of compounds to ASK1 may be determined using a white 384-well-plate format under the following reaction conditions: 25 nM A...				US Patent US8802695 (2014) BindingDB Entry DOI: 10.7270/Q27W69WD
					More data for this Ligand-Target Pair