BDBM21938 8-bromo-4-[(3-chloro-4-fluorophenyl)amino]-6-[({1-[2-(morpholin-4-yl)ethyl]-1H-imidazol-4-yl}methyl)amino]quinoline-3-carbonitrile::Cyanoquinoline, 49
SMILES: Fc1ccc(Nc2c(cnc3c(Br)cc(NCc4cn(CCN5CCOCC5)cn4)cc23)C#N)cc1Cl
InChI Key: InChIKey=UHCMXSOOCRBFCF-UHFFFAOYSA-N
Data: 1 IC50
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 8 (Homo sapiens (Human)) | BDBM21938 (8-bromo-4-[(3-chloro-4-fluorophenyl)amino]-6-[({1-...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
Wyeth Research | Assay Description Tpl2/Cot activity was directly assayed using GST-MEK1 as a substrate. The phosphorylation on serine residues was detected by an ELISA. IC50 calculati... | J Med Chem 50: 4728-45 (2007) Article DOI: 10.1021/jm070436q BindingDB Entry DOI: 10.7270/Q2891441 | |||||||||||
More data for this Ligand-Target Pair |