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Target
Serine/threonine-protein kinase Chk1
Ligand
BDBM50464846
Substrate
n/a
Meas. Tech.
ChEMBL_1782962 (CHEMBL4254479)
IC50
1300±n/a nM
Citation
 Moussa, G; Alaaeddine, R; Alaeddine, LM; Nassra, R; Belal, ASF; Ismail, A; El-Yazbi, AF; Abdel-Ghany, YS; Hazzaa, A Novel click modifiable thioquinazolinones as anti-inflammatory agents: Design, synthesis, biological evaluation and docking study. Eur J Med Chem 144:635-650 (2018) [PubMed]  Article 
Target
Name:
Serine/threonine-protein kinase Chk1
Synonyms:
CHEK1 | CHK1 | CHK1 checkpoint homolog | CHK1_HUMAN | Checkpoint kinase-1 (CHK1)
Type:
Enzyme Catalytic Domain
Mol. Mass.:
54443.02
Organism:
Homo sapiens (Human)
Description:
gi_166295192
Residue:
476
Sequence:
MAVPFVEDWDLVQTLGEGAYGEVQLAVNRVTEEAVAVKIVDMKRAVDCPENIKKEICINKMLNHENVVKFYGHRREGNIQYLFLEYCSGGELFDRIEPDIGMPEPDAQRFFHQLMAGVVYLHGIGITHRDIKPENLLLDERDNLKISDFGLATVFRYNNRERLLNKMCGTLPYVAPELLKRREFHAEPVDVWSCGIVLTAMLAGELPWDQPSDSCQEYSDWKEKKTYLNPWKKIDSAPLALLHKILVENPSARITIPDIKKDRWYNKPLKKGAKRPRVTSGGVSESPSGFSKHIQSNLDFSPVNSASSEENVKYSSSQPEPRTGLSLWDTSPSYIDKLVQGISFSQPTCPDHMLLNSQLLGTPGSSQNPWQRLVKRMTRFFTKLDADKSYQCLKETCEKLGYQWKKSCMNQVTISTTDRRNNKLIFKVNLLEMDDKILVDFRLSKGDGLEFKRHFLKIKGKLIDIVSSQKIWLPAT
  
Inhibitor
Name:
BDBM50464846
Synonyms:
CHEMBL4289051
Type:
Small organic molecule
Emp. Form.:
C30H38N4O2S
Mol. Mass.:
518.713
SMILES:
CCCC[C@@H](Sc1nc2ccccc2c(=O)n1-c1cccc(C)c1)C(=O)N1CCC[C@]2(CCCNC2)C1 |r|
Structure:
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