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Target
Inositol-trisphosphate 3-kinase A
Ligand
BDBM82316
Substrate
n/a
Meas. Tech.
Inhibition Assay
pH
8±0
Temperature
310.15±0 K
IC50
>2.00e+5±n/a nM
Citation
 Chang, YT; Choi, G; Bae, YS; Burdett, M; Moon, HS; Lee, JW; Gray, NS; Schultz, PG; Meijer, L; Chung, SK; Choi, KY; Suh, PG; Ryu, SH Purine-based inhibitors of inositol-1,4,5-trisphosphate-3-kinase. Chembiochem 3:897-901 (2002) [PubMed]  Article 
Target
Name:
Inositol-trisphosphate 3-kinase A
Synonyms:
IP3KA_HUMAN | ITPKA | Inositol 1,4,5-trisphosphate 3-kinase (IP3K ) | Inositol-trisphosphate 3-kinase
Type:
Protein
Mol. Mass.:
51014.30
Organism:
Homo sapiens (Human)
Description:
P23677
Residue:
461
Sequence:
MTLPGGPTGMARPGGARPCSPGLERAPRRSVGELRLLFEARCAAVAAAAAAGEPRARGAKRRGGQVPNGLPRAPPAPVIPQLTVTAEEPDVPPTSPGPPERERDCLPAAGSSHLQQPRRLSTSSVSSTGSSSLLEDSEDDLLSDSESRSRGNVQLEAGEDVGQKNHWQKIRTMVNLPVISPFKKRYAWVQLAGHTGSFKAAGTSGLILKRCSEPERYCLARLMADALRGCVPAFHGVVERDGESYLQLQDLLDGFDGPCVLDCKMGVRTYLEEELTKARERPKLRKDMYKKMLAVDPEAPTEEEHAQRAVTKPRYMQWREGISSSTTLGFRIEGIKKADGSCSTDFKTTRSREQVLRVFEEFVQGDEEVLRRYLNRLQQIRDTLEVSEFFRRHEVIGSSLLFVHDHCHRAGVWLIDFGKTTPLPDGQILDHRRPWEEGNREDGYLLGLDNLIGILASLAER
  
Inhibitor
Name:
BDBM82316
Synonyms:
Purine, 11
Type:
Small organic molecule
Emp. Form.:
C24H25F3N6O
Mol. Mass.:
470.4901
SMILES:
COc1ccc(CNc2nc(NCc3cccc(c3)C(F)(F)F)nc3n(cnc23)C(C)C)cc1
Structure:
Search PDB for entries with ligand similarity: