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Target
Serine/threonine-protein kinase B-raf
Ligand
BDBM50485023
Substrate
n/a
Meas. Tech.
ChEMBL_816296 (CHEMBL2026972)
IC50
10.0±n/a nM
Citation
 Ren, L; Ahrendt, KA; Grina, J; Laird, ER; Buckmelter, AJ; Hansen, JD; Newhouse, B; Moreno, D; Wenglowsky, S; Dinkel, V; Gloor, SL; Hastings, G; Rana, S; Rasor, K; Risom, T; Sturgis, HL; Voegtli, WC; Mathieu, S The discovery of potent and selective pyridopyrimidin-7-one based inhibitors of B-RafV600E kinase. Bioorg Med Chem Lett 22:3387-91 (2012) [PubMed]  Article 
Target
Name:
Serine/threonine-protein kinase B-raf
Synonyms:
B-RAF | B-Raf Protein Kinase | B-Raf proto-oncogene serine/threonine-protein kinase | BRAF | BRAF1 | BRAF_HUMAN | RAFB1 | p94 | v-Raf murine sarcoma viral oncogene homolog B1
Type:
Serine/threonine-protein kinase
Mol. Mass.:
84446.00
Organism:
Homo sapiens (Human)
Description:
P15056
Residue:
766
Sequence:
MAALSGGGGGGAEPGQALFNGDMEPEAGAGAGAAASSAADPAIPEEVWNIKQMIKLTQEHIEALLDKFGGEHNPPSIYLEAYEEYTSKLDALQQREQQLLESLGNGTDFSVSSSASMDTVTSSSSSSLSVLPSSLSVFQNPTDVARSNPKSPQKPIVRVFLPNKQRTVVPARCGVTVRDSLKKALMMRGLIPECCAVYRIQDGEKKPIGWDTDISWLTGEELHVEVLENVPLTTHNFVRKTFFTLAFCDFCRKLLFQGFRCQTCGYKFHQRCSTEVPLMCVNYDQLDLLFVSKFFEHHPIPQEEASLAETALTSGSSPSAPASDSIGPQILTSPSPSKSIPIPQPFRPADEDHRNQFGQRDRSSSAPNVHINTIEPVNIDDLIRDQGFRGDGGSTTGLSATPPASLPGSLTNVKALQKSPGPQRERKSSSSSEDRNRMKTLGRRDSSDDWEIPDGQITVGQRIGSGSFGTVYKGKWHGDVAVKMLNVTAPTPQQLQAFKNEVGVLRKTRHVNILLFMGYSTKPQLAIVTQWCEGSSLYHHLHIIETKFEMIKLIDIARQTAQGMDYLHAKSIIHRDLKSNNIFLHEDLTVKIGDFGLATVKSRWSGSHQFEQLSGSILWMAPEVIRMQDKNPYSFQSDVYAFGIVLYELMTGQLPYSNINNRDQIIFMVGRGYLSPDLSKVRSNCPKAMKRLMAECLKKKRDERPLFPQILASIELLARSLPKIHRSASEPSLNRAGFQTEDFSLYACASPKTPIQAGGYGAFPVH
  
Inhibitor
Name:
BDBM50485023
Synonyms:
CHEMBL2023340
Type:
Small organic molecule
Emp. Form.:
C17H17F2N5O3S
Mol. Mass.:
409.41
SMILES:
CCCS(=O)(=O)Nc1ccc(F)c(c1F)-c1cc2cnc(N)nc2n(C)c1=O |(9.34,-.05,;8.01,.72,;6.67,-.05,;5.35,.71,;4.57,2.06,;6.11,2.06,;4.01,-.06,;2.68,.71,;2.67,2.26,;1.34,3.02,;.01,2.25,;-1.32,3.02,;.01,.71,;1.34,-.07,;1.34,-1.61,;-1.32,-.06,;-2.65,.72,;-3.98,-.05,;-5.31,.72,;-6.64,-.04,;-6.64,-1.58,;-7.97,-2.35,;-5.31,-2.34,;-3.99,-1.59,;-2.65,-2.36,;-2.65,-3.9,;-1.32,-1.59,;.02,-2.36,)|
Structure:
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