BDBM107673 1-(3-(6-Chloro-2-methylpyrimidin-4-ylamino)phenyl)- 3-(4-chloro-3-(trifluoromethyl)phenyl)urea (Compound 1)
SMILES: Cc1nc(Cl)cc(Nc2cccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)c2)n1
InChI Key: InChIKey=OQNAEPJXWHOMFY-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Serine/threonine-protein kinase B-raf [V600E] (Homo sapiens (Human)) | BDBM107673 (1-(3-(6-Chloro-2-methylpyrimidin-4-ylamino)phenyl)...) | PDB GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 298 | n/a | n/a | n/a | n/a | 7.5 | 25 |
Shanghai Institute of Pharmaceutical Industry, 1111 Zhongshan North One Road, Hongkou District, Shanghai, 200437, China | Assay Description Compounds were prepared in DMSO at 10mmol/L and serially diluted in a 96-well plate as the source plate. The intermediate plate consists of 4µL... | Chem Biol Drug Des 83: 27-36 (2014) Article DOI: 10.1111/cbdd.12198 BindingDB Entry DOI: 10.7270/Q2VH5MHM | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serine/threonine-protein kinase B-raf (Homo sapiens (Human)) | BDBM107673 (1-(3-(6-Chloro-2-methylpyrimidin-4-ylamino)phenyl)...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 722 | n/a | n/a | n/a | n/a | 7.5 | 25 |
Shanghai Institute of Pharmaceutical Industry, 1111 Zhongshan North One Road, Hongkou District, Shanghai, 200437, China | Assay Description Compounds were prepared in DMSO at 10mmol/L and serially diluted in a 96-well plate as the source plate. The intermediate plate consists of 4µL... | Chem Biol Drug Des 83: 27-36 (2014) Article DOI: 10.1111/cbdd.12198 BindingDB Entry DOI: 10.7270/Q2VH5MHM | |||||||||||
More data for this Ligand-Target Pair |