Target
RAF proto-oncogene serine/threonine-protein kinase [Y340E,Y341E]
Ligand
BDBM88043
Substrate
MEK1 (K97R)
Meas. Tech.
Raf Activity Assay
pH
7.5±n/a
Temperature
298.15±n/a K
IC50
0.79±n/a nM
Comments
extracted
Citation
 Aversa, RJBarsanti, PABurger, MDillon, MPDipesa, AHu, CLou, YNishiguchi, GPan, YPolyakov, VRamurthy, SRico, ASetti, LSmith, ASubramanian, STaft, BTanner, HWan, LYusuff, N Biaryl amide compounds as kinase inhibitors US Patent  US9694016 Publication Date 7/4/2017 
Target
Name:
RAF proto-oncogene serine/threonine-protein kinase [Y340E,Y341E]
Synonyms:
C-RAF | Proto-oncogene C-Raf (C-Raf FL) | RAF | RAF proto-oncogene serine/threonine-protein kinase | RAF1 | RAF1_HUMAN
Type:
n/a
Mol. Mass.:
73012.38
Organism:
Homo sapiens (Human)
Description:
P04049[Y340E,Y341E]
Residue:
648
Sequence:
MEHIQGAWKTISNGFGFKDAVFDGSSCISPTIVQQFGYQRRASDDGKLTDPSKTSNTIRVFLPNKQRTVVNVRNGMSLHDCLMKALKVRGLQPECCAVFRLLHEHKGKKARLDWNTDAASLIGEELQVDFLDHVPLTTHNFARKTFLKLAFCDICQKFLLNGFRCQTCGYKFHEHCSTKVPTMCVDWSNIRQLLLFPNSTIGDSGVPALPSLTMRRMRESVSRMPVSSQHRYSTPHAFTFNTSSPSSEGSLSQRQRSTSTPNVHMVSTTLPVDSRMIEDAIRSHSESASPSALSSSPNNLSPTGWSQPKTPVPAQRERAPVSGTQEKNKIRPRGQRDSSEEWEIEASEVMLSTRIGSGSFGTVYKGKWHGDVAVKILKVVDPTPEQFQAFRNEVAVLRKTRHVNILLFMGYMTKDNLAIVTQWCEGSSLYKHLHVQETKFQMFQLIDIARQTAQGMDYLHAKNIIHRDMKSNNIFLHEGLTVKIGDFGLATVKSRWSGSQQVEQPTGSVLWMAPEVIRMQDNNPFSFQSDVYSYGIVLYELMTGELPYSHINNRDQIIFMVGRGYASPDLSKLYKNCPKAMKRLVADCVKKVKEERPLFPQILSSIELLQHSLPKINRSASEPSLHRAAHTEDINACTLTTSPRLPVF
  
Inhibitor
Name:
BDBM88043
Synonyms:
US10245267, Example 1078 | US10709712, Example 1078 | US9694016, 1078
Type:
Small organic molecule
Emp. Form.:
C27H29F2N5O3
Mol. Mass.:
509.5477
SMILES:
Cc1ccc(NC(=O)c2ccnc(c2)C(C)(F)F)cc1-c1cc(nc(c1)N1CCOCC1)N1CC(O)C1
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
Dual specificity mitogen-activated protein kinase kinase 1 [K97R]
Synonyms:
Dual specificity mitogen-activated protein kinase kinase 1 (MEK1)(K97R) | MAP2K1 | MEK1 | MEK1 (K97R) | MP2K1_HUMAN | PRKMK1
Type:
n/a
Mol. Mass.:
43467.04
Organism:
Homo sapiens (Human)
Description:
Biotinylated full length MEK1 with an inactivating K97R ATP binding site mutation.
Residue:
393
Sequence:
MPKKKPTPIQLNPAPDGSAVNGTSSAETNLEALQKKLEELELDEQQRKRLEAFLTQKQKVGELKDDDFEKISELGAGNGGVVFKVSHKPSGLVMARRLIHLEIKPAIRNQIIRELQVLHECNSPYIVGFYGAFYSDGEISICMEHMDGGSLDQVLKKAGRIPEQILGKVSIAVIKGLTYLREKHKIMHRDVKPSNILVNSRGEIKLCDFGVSGQLIDSMANSFVGTRSYMSPERLQGTHYSVQSDIWSMGLSLVEMAVGRYPIPPPDAKELELMFGCQVEGDAAETPPRPRTPGRPLSSYGMDSRPPMAIFELLDYIVNEPPPKLPSGVFSLEFQDFVNKCLIKNPAERADLKQLMVHAFIKRSDAEEVDFAGWLCSTIGLNQPSTPTHAAGV