Target
Serine/threonine-protein kinase Chk2
Ligand
BDBM50359809
Substrate
n/a
Meas. Tech.
ChEMBL_791991 (CHEMBL1930051)
IC50
12000±n/a nM
Citation
 Reader, JCMatthews, TPKlair, SCheung, KMScanlon, JProisy, NAddison, GEllard, JPiton, NTaylor, SCherry, MFisher, MBoxall, KBurns, SWalton, MIWestwood, IMHayes, AEve, PValenti, Mde Haven Brandon, ABox, Gvan Montfort, RLWilliams, DHAherne, GWRaynaud, FIEccles, SAGarrett, MDCollins, I Structure-guided evolution of potent and selective CHK1 inhibitors through scaffold morphing. J Med Chem 54:8328-42 (2011) [PubMed]  Article 
Target
Name:
Serine/threonine-protein kinase Chk2
Synonyms:
CDS1 | CHEK2 | CHK2 | CHK2_HUMAN | Checkpoint Kinase (Chk2) | RAD53 | Serine/threonine-protein kinase Chek2 | Serine/threonine-protein kinase Chk1/2
Type:
Protein
Mol. Mass.:
60908.59
Organism:
Homo sapiens (Human)
Description:
O96017
Residue:
543
Sequence:
MSRESDVEAQQSHGSSACSQPHGSVTQSQGSSSQSQGISSSSTSTMPNSSQSSHSSSGTLSSLETVSTQELYSIPEDQEPEDQEPEEPTPAPWARLWALQDGFANLECVNDNYWFGRDKSCEYCFDEPLLKRTDKYRTYSKKHFRIFREVGPKNSYIAYIEDHSGNGTFVNTELVGKGKRRPLNNNSEIALSLSRNKVFVFFDLTVDDQSVYPKALRDEYIMSKTLGSGACGEVKLAFERKTCKKVAIKIISKRKFAIGSAREADPALNVETEIEILKKLNHPCIIKIKNFFDAEDYYIVLELMEGGELFDKVVGNKRLKEATCKLYFYQMLLAVQYLHENGIIHRDLKPENVLLSSQEEDCLIKITDFGHSKILGETSLMRTLCGTPTYLAPEVLVSVGTAGYNRAVDCWSLGVILFICLSGYPPFSEHRTQVSLKDQITSGKYNFIPEVWAEVSEKALDLVKKLLVVDPKARFTTEEALRHPWLQDEDMKRKFQDLLSEENESTALPQVLAQPSTSRKRPREGEAEGAETTKRPAVCAAVL
  
Inhibitor
Name:
BDBM50359809
Synonyms:
CHEMBL1928702
Type:
Small organic molecule
Emp. Form.:
C18H17ClN6O
Mol. Mass.:
368.82
SMILES:
CN(C)CCOc1nc(Nc2cc3cccc(Cl)c3cn2)cnc1C#N
Structure:
Search PDB for entries with ligand similarity: