Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetCalcium/calmodulin-dependent protein kinase kinase 2
LigandBDBM50572896
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2118550 (CHEMBL4827616)
IC50 170±n/a nM
Citation Eduful, BJO'Byrne, SNTemme, LAsquith, CRMLiang, YPicado, APilotte, JRHossain, MAWells, CIZuercher, WJCatta-Preta, CMCZonzini Ramos, PSantiago, ASCouņago, RMLangendorf, CGNay, KOakhill, JSPulliam, TLLin, CAwad, DWillson, TMFrigo, DEScott, JWDrewry, DH Hinge Binder Scaffold Hopping Identifies Potent Calcium/Calmodulin-Dependent Protein Kinase Kinase 2 (CAMKK2) Inhibitor Chemotypes. J Med Chem64:10849-10877 (2021) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Calcium/calmodulin-dependent protein kinase kinase 2
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:
MSSCVSSQPSSNRAAPQDELGGRGSSSSESQKPCEALRGLSSLSIHLGMESFIVVTECEP
GCAVDLGLARDRPLEADGQEVPLDTSGSQARPHLSGRKLSLQERSQGGLAAGGSLDMNGR
CICPSLPYSPVSSPQSSPRLPRRPTVESHHVSITGMQDCVQLNQYTLKDEIGKGSYGVVK
LAYNENDNTYYAMKVLSKKKLIRQAGFPRRPPPRGTRPAPGGCIQPRGPIEQVYQEIAIL
KKLDHPNVVKLVEVLDDPNEDHLYMVFELVNQGPVMEVPTLKPLSEDQARFYFQDLIKGI
EYLHYQKIIHRDIKPSNLLVGEDGHIKIADFGVSNEFKGSDALLSNTVGTPAFMAPESLS
ETRKIFSGKALDVWAMGVTLYCFVFGQCPFMDERIMCLHSKIKSQALEFPDQPDIAEDLK
DLITRMLDKNPESRIVVPEIKLHPWVTRHGAEPLPSEDENCTLVEVTEEEVENSVKHIPS
LATVILVKTMIRKRSFGNPFEGSRREERSLSAPGNLLTKKPTRECESLSELKEARQRRQP
PGHRPAPRGGGGSALVRGSPCVESCWAPAPGSPARMHPLRPEEAMEPE
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50572896
n/a
NameBDBM50572896
Synonyms:CHEMBL4862562
TypeSmall organic molecule
Emp. Form.C18H16N2O2S
Mol. Mass.324.397
SMILESOC(=O)c1ccc(cc1C1CCCC1)-c1ncnc2ccsc12
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: