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Target
Serine/threonine-protein kinase pim-1
Ligand
BDBM50345245
Substrate
n/a
Meas. Tech.
ChEMBL_752073 (CHEMBL1786237)
IC50
53±n/a nM
Citation
 Xiang, Y; Hirth, B; Asmussen, G; Biemann, HP; Bishop, KA; Good, A; Fitzgerald, M; Gladysheva, T; Jain, A; Jancsics, K; Liu, J; Metz, M; Papoulis, A; Skerlj, R; Stepp, JD; Wei, RR The discovery of novel benzofuran-2-carboxylic acids as potent Pim-1 inhibitors. Bioorg Med Chem Lett 21:3050-6 (2011) [PubMed]  Article 
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:
BDBM50345245
Synonyms:
CHEMBL1782516 | trans-5-(6-(4-(aminomethyl)cyclohexylamino)pyrazin-2-yl)benzofuran-2-carboxylic acid
Type:
Small organic molecule
Emp. Form.:
C20H22N4O3
Mol. Mass.:
366.4137
SMILES:
NC[C@H]1CC[C@@H](CC1)Nc1cncc(n1)-c1ccc2oc(cc2c1)C(O)=O |r,wU:5.8,wD:2.1,(-10.87,-26.04,;-9.53,-25.27,;-8.19,-26.04,;-8.19,-27.58,;-6.85,-28.36,;-5.52,-27.57,;-5.53,-26.04,;-6.86,-25.28,;-4.19,-28.34,;-2.86,-27.56,;-2.86,-26.02,;-1.53,-25.25,;-.2,-26.02,;-.2,-27.56,;-1.53,-28.33,;1.13,-28.32,;1.13,-29.87,;2.46,-30.64,;3.8,-29.86,;5.26,-30.33,;6.16,-29.08,;5.25,-27.83,;3.79,-28.32,;2.46,-27.56,;7.7,-29.07,;8.48,-30.39,;8.46,-27.73,)|
Structure:
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