BDBM50072726 CHEMBL3410057

SMILES: COc1ccc(NC(=O)N(C)c2ccc(cc2)-c2ncnc3[nH]cc(C)c23)cc1

InChI Key: InChIKey=GUOXILPRENYZHU-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 = 50072726   

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
LIM domain kinase 1 (Homo sapiens (Human))	BDBM50072726 (CHEMBL3410057) Show SMILES COc1ccc(NC(=O)N(C)c2ccc(cc2)-c2ncnc3[nH]cc(C)c23)cc1 Show InChI InChI=1S/C22H21N5O2/c1-14-12-23-21-19(14)20(24-13-25-21)15-4-8-17(9-5-15)27(2)22(28)26-16-6-10-18(29-3)11-7-16/h4-13H,1-3H3,(H,26,28)(H,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
Translational Research Institute Curated by ChEMBL					Assay Description Inhibition of human Limk1 using cofilin substrate, ATP and [gamma33P]ATP				J Med Chem 58: 1846-61 (2015) Article DOI: 10.1021/jm501680m BindingDB Entry DOI: 10.7270/Q2K64KRC
					More data for this Ligand-Target Pair