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Target
Calcium/calmodulin-dependent protein kinase kinase 2
Ligand
BDBM50572891
Substrate
n/a
Meas. Tech.
ChEMBL_2118550 (CHEMBL4827616)
IC50
240±n/a nM
Citation
 Eduful, BJ; O'Byrne, SN; Temme, L; Asquith, CRM; Liang, Y; Picado, A; Pilotte, JR; Hossain, MA; Wells, CI; Zuercher, WJ; Catta-Preta, CMC; Zonzini Ramos, P; Santiago, AS; Couņago, RM; Langendorf, CG; Nay, K; Oakhill, JS; Pulliam, TL; Lin, C; Awad, D; Willson, TM; Frigo, DE; Scott, JW; Drewry, DH Hinge Binder Scaffold Hopping Identifies Potent Calcium/Calmodulin-Dependent Protein Kinase Kinase 2 (CAMKK2) Inhibitor Chemotypes. J Med Chem 64:10849-10877 (2021) [PubMed]  Article 
Target
Name:
Calcium/calmodulin-dependent protein kinase kinase 2
Synonyms:
CAMKK2 | CAMKKB | Calcium/calmodulin-dependent protein kinase kinase 2 (CaMKKB) | Calcium/calmodulin-dependent protein kinase kinase beta | KIAA0787 | KKCC2_HUMAN
Type:
Enzyme Catalytic Domain
Mol. Mass.:
64746.61
Organism:
Homo sapiens (Human)
Description:
gi_27437015
Residue:
588
Sequence:
MSSCVSSQPSSNRAAPQDELGGRGSSSSESQKPCEALRGLSSLSIHLGMESFIVVTECEPGCAVDLGLARDRPLEADGQEVPLDTSGSQARPHLSGRKLSLQERSQGGLAAGGSLDMNGRCICPSLPYSPVSSPQSSPRLPRRPTVESHHVSITGMQDCVQLNQYTLKDEIGKGSYGVVKLAYNENDNTYYAMKVLSKKKLIRQAGFPRRPPPRGTRPAPGGCIQPRGPIEQVYQEIAILKKLDHPNVVKLVEVLDDPNEDHLYMVFELVNQGPVMEVPTLKPLSEDQARFYFQDLIKGIEYLHYQKIIHRDIKPSNLLVGEDGHIKIADFGVSNEFKGSDALLSNTVGTPAFMAPESLSETRKIFSGKALDVWAMGVTLYCFVFGQCPFMDERIMCLHSKIKSQALEFPDQPDIAEDLKDLITRMLDKNPESRIVVPEIKLHPWVTRHGAEPLPSEDENCTLVEVTEEEVENSVKHIPSLATVILVKTMIRKRSFGNPFEGSRREERSLSAPGNLLTKKPTRECESLSELKEARQRRQPPGHRPAPRGGGGSALVRGSPCVESCWAPAPGSPARMHPLRPEEAMEPE
  
Inhibitor
Name:
BDBM50572891
Synonyms:
CHEMBL4869147
Type:
Small organic molecule
Emp. Form.:
C26H24N2O2
Mol. Mass.:
396.481
SMILES:
Cn1c(cc2c(ccnc12)-c1ccc(C(O)=O)c(c1)C1CCCC1)-c1ccccc1
Structure:
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