Reaction Details Report a problem with these data
Target
Wee1-like protein kinase
Ligand
BDBM264250
Substrate
n/a
Meas. Tech.
Wee-1 kinase Assay
Temperature
298.15±n/a K
IC50
105±n/a nM
Comments
extracted
Citation
 O Dowd, CR; Rountree, JS; Burkamp, F; Wilkinson, AJ Substituted pyrido[4,3-d]pyrimidines as Wee-1 inhibitors US Patent  US9714244 Publication Date 7/25/2017 
Target
Name:
Wee1-like protein kinase
Synonyms:
Serine/threonine-protein kinase WEE1 | WEE1 | WEE1 homolog (S. pombe) | WEE1_HUMAN
Type:
PROTEIN
Mol. Mass.:
71599.12
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1445054
Residue:
646
Sequence:
MSFLSRQQPPPPRRAGAACTLRQKLIFSPCSDCEEEEEEEEEEGSGHSTGEDSAFQEPDSPLPPARSPTEPGPERRRSPGPAPGSPGELEEDLLLPGACPGADEAGGGAEGDSWEEEGFGSSSPVKSPAAPYFLGSSFSPVRCGGPGDASPRGCGARRAGEGRRSPRPDHPGTPPHKTFRKLRLFDTPHTPKSLLSKARGIDSSSVKLRGSSLFMDTEKSGKREFDVRQTPQVNINPFTPDSLLLHSSGQCRRRKRTYWNDSCGEDMEASDYELEDETRPAKRITITESNMKSRYTTEFHELEKIGSGEFGSVFKCVKRLDGCIYAIKRSKKPLAGSVDEQNALREVYAHAVLGQHSHVVRYFSAWAEDDHMLIQNEYCNGGSLADAISENYRIMSYFKEAELKDLLLQVGRGLRYIHSMSLVHMDIKPSNIFISRTSIPNAASEEGDEDDWASNKVMFKIGDLGHVTRISSPQVEEGDSRFLANEVLQENYTHLPKADIFALALTVVCAAGAEPLPRNGDQWHEIRQGRLPRIPQVLSQEFTELLKVMIHPDPERRPSAMALVKHSVLLSASRKSAEQLRIELNAEKFKNSLLQKELKKAQMAKAAAEERALFTDRMATRSTTQSNRTSRLIGKKMNRSVSLTIY
  
Inhibitor
Name:
BDBM264250
Synonyms:
2-((4-(4-Acetylpiperazin-1-yl)phenyl)amino)-6-(2,6-dichlorophenyl)pyrido[4,3-d]pyrimidin-5(6H)-one | US9714244, 5
Type:
Small organic molecule
Emp. Form.:
C25H22Cl2N6O2
Mol. Mass.:
509.387
SMILES:
CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3c(ccn(-c4c(Cl)cccc4Cl)c3=O)n2)cc1 |(-10.67,1.16,;-9.34,1.93,;-9.34,3.47,;-8,1.16,;-8,-.39,;-6.67,-1.16,;-5.33,-.39,;-5.33,1.16,;-6.67,1.93,;-4,-1.16,;-4,-2.7,;-2.67,-3.47,;-1.33,-2.7,;,-3.47,;1.33,-2.7,;1.33,-1.16,;2.67,-.39,;4,-1.16,;4,-2.7,;5.33,-3.47,;6.67,-2.7,;6.67,-1.16,;8,-.39,;9.34,-1.16,;9.34,-2.7,;10.67,-.39,;10.67,1.16,;9.34,1.93,;8,1.16,;6.67,1.93,;5.33,-.39,;5.33,1.16,;2.67,-3.47,;-1.33,-1.16,;-2.67,-.39,)|
Structure:
Search PDB for entries with ligand similarity: