BDBM128414 US8802695, 31

SMILES: Cn1cc(Cl)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12

InChI Key: InChIKey=GVZZEAPBOBILMV-SFHVURJKSA-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 = 128414   

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 (Homo sapiens (Human))	BDBM128414 (US8802695, 31) Show SMILES Cn1cc(Cl)c2cnc(NC(=O)c3ccc(cc3)[C@@](C)(O)CO)cc12 |r| Show InChI InChI=1S/C18H18ClN3O3/c1-18(25,10-23)12-5-3-11(4-6-12)17(24)21-16-7-15-13(8-20-16)14(19)9-22(15)2/h3-9,23,25H,10H2,1-2H3,(H,20,21,24)/t18-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	19	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