Target
Serine/threonine-protein kinase Nek2
Ligand
BDBM50330586
Substrate
n/a
Meas. Tech.
ChEMBL_685025 (CHEMBL1286641)
IC50
1400±n/a nM
Citation
 Whelligan, DKSolanki, STaylor, DThomson, DWCheung, KMBoxall, KMas-Droux, CBarillari, CBurns, SGrummitt, CGCollins, Ivan Montfort, RLAherne, GWBayliss, RHoelder, S Aminopyrazine inhibitors binding to an unusual inactive conformation of the mitotic kinase Nek2: SAR and structural characterization. J Med Chem 53:7682-98 (2010) [PubMed]  Article 
Target
Name:
Serine/threonine-protein kinase Nek2
Synonyms:
NEK kinase | NEK2 | NEK2A | NEK2_HUMAN | NLK1
Type:
Enzyme
Mol. Mass.:
51776.96
Organism:
Homo sapiens (Human)
Description:
P51955
Residue:
445
Sequence:
MPSRAEDYEVLYTIGTGSYGRCQKIRRKSDGKILVWKELDYGSMTEAEKQMLVSEVNLLRELKHPNIVRYYDRIIDRTNTTLYIVMEYCEGGDLASVITKGTKERQYLDEEFVLRVMTQLTLALKECHRRSDGGHTVLHRDLKPANVFLDGKQNVKLGDFGLARILNHDTSFAKTFVGTPYYMSPEQMNRMSYNEKSDIWSLGCLLYELCALMPPFTAFSQKELAGKIREGKFRRIPYRYSDELNEIITRMLNLKDYHRPSVEEILENPLIADLVADEQRRNLERRGRQLGEPEKSQDSSPVLSELKLKEIQLQERERALKAREERLEQKEQELCVRERLAEDKLARAENLLKNYSLLKERKFLSLASNPELLNLPSSVIKKKVHFSGESKENIMRSENSESQLTSKSKCKDLKKRLHAAQLRAQALSDIEKNYQLKSRQILGMR
  
Inhibitor
Name:
BDBM50330586
Synonyms:
(+/-)-(2R,4R)-1-(3-amino-6-(3,4,5-trimethoxyphenyl)pyrazin-2-yl)-2-ethylpiperidine-4-carboxylic acid | CHEMBL1278189
Type:
Small organic molecule
Emp. Form.:
C21H28N4O5
Mol. Mass.:
416.4708
SMILES:
CC[C@@H]1C[C@@H](CCN1c1nc(cnc1N)-c1cc(OC)c(OC)c(OC)c1)C(O)=O |r|
Structure:
Search PDB for entries with ligand similarity: