Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetSerine/threonine-protein kinase B-raf
LigandBDBM88120
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2047188 (CHEMBL4701887)
IC50 78±n/a nM
Citation LaMarche, MJAcker, MArgintaru, ABauer, DBoisclair, JChan, HChen, CHChen, YNChen, ZDeng, ZDore, MDunstan, DFan, JFekkes, PFirestone, BFodor, MGarcia-Fortanet, JFortin, PDFridrich, CGiraldes, JGlick, MGrunenfelder, DHao, HXHentemann, MHo, SJouk, AKang, ZBKarki, RKato, MKeen, NKoenig, RLaBonte, LRLarrow, JLiu, GLiu, SMajumdar, DMathieu, SMeyer, MJMohseni, MNtaganda, RPalermo, MPerez, LPu, MRamsey, TReilly, JSarver, PSellers, WRSendzik, MShultz, MDSlisz, JSlocum, KSmith, TSpence, SStams, TStraub, CTamez, VToure, BBTowler, CWang, PWang, HWilliams, SLYang, FYu, BZhang, JHZhu, S Identification of TNO155, an Allosteric SHP2 Inhibitor for the Treatment of Cancer. J Med Chem63:13578-13594 (2020) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Serine/threonine-protein kinase B-raf
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:
MAALSGGGGGGAEPGQALFNGDMEPEAGAGAGAAASSAADPAIPEEVWNIKQMIKLTQEH
IEALLDKFGGEHNPPSIYLEAYEEYTSKLDALQQREQQLLESLGNGTDFSVSSSASMDTV
TSSSSSSLSVLPSSLSVFQNPTDVARSNPKSPQKPIVRVFLPNKQRTVVPARCGVTVRDS
LKKALMMRGLIPECCAVYRIQDGEKKPIGWDTDISWLTGEELHVEVLENVPLTTHNFVRK
TFFTLAFCDFCRKLLFQGFRCQTCGYKFHQRCSTEVPLMCVNYDQLDLLFVSKFFEHHPI
PQEEASLAETALTSGSSPSAPASDSIGPQILTSPSPSKSIPIPQPFRPADEDHRNQFGQR
DRSSSAPNVHINTIEPVNIDDLIRDQGFRGDGGSTTGLSATPPASLPGSLTNVKALQKSP
GPQRERKSSSSSEDRNRMKTLGRRDSSDDWEIPDGQITVGQRIGSGSFGTVYKGKWHGDV
AVKMLNVTAPTPQQLQAFKNEVGVLRKTRHVNILLFMGYSTKPQLAIVTQWCEGSSLYHH
LHIIETKFEMIKLIDIARQTAQGMDYLHAKSIIHRDLKSNNIFLHEDLTVKIGDFGLATV
KSRWSGSHQFEQLSGSILWMAPEVIRMQDKNPYSFQSDVYAFGIVLYELMTGQLPYSNIN
NRDQIIFMVGRGYLSPDLSKVRSNCPKAMKRLMAECLKKKRDERPLFPQILASIELLARS
LPKIHRSASEPSLNRAGFQTEDFSLYACASPKTPIQAGGYGAFPVH
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM88120
n/a
NameBDBM88120
Synonyms:US10245267, Example 1156 | US10709712, Example 1156 | US9694016, 1156
TypeSmall organic molecule
Emp. Form.C25H25F3N4O4
Mol. Mass.502.4856
SMILESCc1ccc(NC(=O)c2ccnc(c2)C(F)(F)F)cc1-c1cc(OCCO)nc(c1)N1CCOCC1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: