Reaction Details Report a problem with these data
Target
Serine/threonine-protein kinase pim-1
Ligand
BDBM393428
Substrate
n/a
Meas. Tech.
Biological Assay
Ki
0.173±n/a nM
Citation
 Burch, J; Chen, H; Wang, X Oxepan-2-yl-pyrazol-4-yl-heterocyclyl-carboxamide compounds and methods of use US Patent  US9963446 Publication Date 5/8/2018 
Target
Name:
Serine/threonine-protein kinase pim-1
Synonyms:
PIM-1 Kinase | PIM1 | PIM1_HUMAN | Proto-oncogene serine/threonine-protein kinase Pim-1 | Serine/threonine-protein kinase (PIM1) | Serine/threonine-protein kinase PIM | Serine/threonine-protein kinase PIM1 | Serine/threonine-protein kinase pim-1 (PIM1)
Type:
Protein
Mol. Mass.:
35681.82
Organism:
Homo sapiens (Human)
Description:
P11309
Residue:
313
Sequence:
MLLSKINSLAHLRAAPCNDLHATKLAPGKEKEPLESQYQVGPLLGSGGFGSVYSGIRVSDNLPVAIKHVEKDRISDWGELPNGTRVPMEVVLLKKVSSGFSGVIRLLDWFERPDSFVLILERPEPVQDLFDFITERGALQEELARSFFWQVLEAVRHCHNCGVLHRDIKDENILIDLNRGELKLIDFGSGALLKDTVYTDFDGTRVYSPPEWIRYHRYHGRSAAVWSLGILLYDMVCGDIPFEHDEEIIRGQVFFRQRVSSECQHLIRWCLALRPSDRPTFEEIQNHPWMQDVLLPQETAEIHLHSLSPGPSK
  
Inhibitor
Name:
BDBM393428
Synonyms:
N-[5-[(2R,5S,6R)-5-amino-6- fluoro-oxepan-2-yl]-1- cyclopropyl-pyrazol-4-yl]-6- (2,6-difluorophenyl)-5-fluoro- pyridine-2-carboxamide | US9963446, Example 114
Type:
Small organic molecule
Emp. Form.:
C24H23F4N5O2
Mol. Mass.:
489.4653
SMILES:
N[C@H]1CC[C@@H](OC[C@@H]1F)c1c(NC(=O)c2ccc(F)c(n2)-c2c(F)cccc2F)cnn1C1CC1 |r,wU:7.8,4.9,wD:1.0,(1.07,5.87,;.3,4.54,;-1.24,4.54,;-2.2,3.33,;-1.86,1.83,;-.47,1.16,;.92,1.83,;1.26,3.33,;2.75,3.73,;-3.19,1.06,;-3.19,-.48,;-1.86,-1.25,;-1.86,-2.79,;-3.19,-3.56,;-.52,-3.56,;-.52,-5.1,;.81,-5.87,;2.14,-5.1,;3.48,-5.87,;2.14,-3.56,;.81,-2.79,;3.48,-2.79,;4.81,-3.56,;4.81,-5.1,;6.14,-2.79,;6.14,-1.25,;4.81,-.48,;3.48,-1.25,;2.14,-.48,;-4.66,-.96,;-5.56,.29,;-4.66,1.54,;-5.05,3.02,;-4.66,4.51,;-6.14,4.11,)|
Structure:
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