BDBM50187116 CHEMBL3822538

SMILES: COc1cc(ccc1NC(=O)c1csc2cncnc12)N1CCN(C)CC1

InChI Key: InChIKey=ZLICGWNMYARRTJ-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 = 50187116   

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 7 (Homo sapiens (Human))	BDBM50187116 (CHEMBL3822538) Show SMILES COc1cc(ccc1NC(=O)c1csc2cncnc12)N1CCN(C)CC1 Show InChI InChI=1S/C19H21N5O2S/c1-23-5-7-24(8-6-23)13-3-4-15(16(9-13)26-2)22-19(25)14-11-27-17-10-20-12-21-18(14)17/h3-4,9-12H,5-8H2,1-2H3,(H,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chugai Pharmaceutical Co,. Ltd Curated by ChEMBL					Assay Description Inhibition of GST-tagged TAK1 (unknown origin) expressed in sf9 cells coexpressing His-tagged TAB1 using myelin basic protein as substrate incubated ...				Bioorg Med Chem 24: 4206-4217 (2016) BindingDB Entry DOI: 10.7270/Q2JM2CKQ
					More data for this Ligand-Target Pair