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Target
Creatine kinase M-type
Ligand
BDBM50370908
Substrate
n/a
Meas. Tech.
ChEMBL_429452 (CHEMBL917695)
Ki
25000±n/a nM
Citation
 Bretonnet, AS; Jochum, A; Walker, O; Krimm, I; Goekjian, P; Marcillat, O; Lancelin, JM NMR screening applied to the fragment-based generation of inhibitors of creatine kinase exploiting a new interaction proximate to the ATP binding site. J Med Chem 50:1865-75 (2007) [PubMed]  Article 
Target
Name:
Creatine kinase M-type
Synonyms:
CKM | Creatine kinase M chain | KCRM_RABIT | M-CK
Type:
PROTEIN
Mol. Mass.:
43117.10
Organism:
Oryctolagus cuniculus
Description:
ChEMBL_429452
Residue:
381
Sequence:
MPFGNTHNKYKLNYKSEEEYPDLSKHNNHMAKVLTPDLYKKLRDKETPSGFTLDDVIQTGVDNPGHPFIMTVGCVAGDEESYTVFKDLFDPIIQDRHGGFKPTDKHKTDLNHENLKGGDDLDPHYVLSSRVRTGRSIKGYTLPPHCSRGERRAVEKLSVEALNSLTGEFKGKYYPLKSMTEQEQQQLIDDHFLFDKPVSPLLLASGMARDWPDARGIWHNDNKSFLVWVNEEDHLRVISMEKGGNMKEVFRRFCVGLQKIEEIFKKAGHPFMWNEHLGYVLTCPSNLGTGLRGGVHVKLAHLSKHPKFEEILTRLRLQKRGTGGVDTAAVGSVFDISNADRLGSSEVEQVQLVVDGVKLMVEMEKKLEKGQSIDDMIPAQK
  
Inhibitor
Name:
BDBM50370908
Synonyms:
CHEMBL373782
Type:
Small organic molecule
Emp. Form.:
C25H17NO5
Mol. Mass.:
411.4062
SMILES:
OC(=O)c1ccc(o1)-c1ccc(cc1)C(=O)Nc1ccc(cc1)C(=O)c1ccccc1
Structure:
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