BDBM25606 1-[4-({6-[(3,4,5-trimethoxyphenyl)amino]pyrazin-2-yl}oxy)phenyl]ethan-1-one::2,6-Disubstituted Pyrazine, 69

SMILES: COc1cc(Nc2cncc(Oc3ccc(cc3)C(C)=O)n2)cc(OC)c1OC

InChI Key: InChIKey=XUWADPNJQFVSNJ-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 = 25606   

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
Serine/threonine-protein kinase B-raf [V600E] (Homo sapiens (Human))	BDBM25606 (1-[4-({6-[(3,4,5-trimethoxyphenyl)amino]pyrazin-2-...) Show SMILES COc1cc(Nc2cncc(Oc3ccc(cc3)C(C)=O)n2)cc(OC)c1OC Show InChI InChI=1S/C21H21N3O5/c1-13(25)14-5-7-16(8-6-14)29-20-12-22-11-19(24-20)23-15-9-17(26-2)21(28-4)18(10-15)27-3/h5-12H,1-4H3,(H,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Cancer Research UK Centre for Cancer Therapeutics					Assay Description BRAF kinase activity was quantified using a DELFIA-based MEK1 phosphorylation assay. IC50 values were derived from the sigmoidal dose-response curves...				J Med Chem 51: 3261-74 (2008) Article DOI: 10.1021/jm070776b BindingDB Entry DOI: 10.7270/Q2X34VRR
					More data for this Ligand-Target Pair