Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(1R,2R,3S,4S,5R,6S)-5-(2-aminoethoxy)-3,6-dihydroxycyclohexane-1,2,4-triyl triphosphate
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 PubChem ID
CID: 44123621
Canonical SMILES
NCCO[C@@H]1[C@H](O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@@H](O)[C@@H]1OP(O)(O)=O
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Compound Formula C8H20NO15P3
Compound Structure
Protein Name
 Protein Info 
Inositol 1,4,5-trisphosphate receptor type 1
Protein Classification
Ion channel
>
Ligand-gated ion channel
>
IP3 receptor
Uniprot ID
P29994
Gene Name
ITPR1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000302 DT40
 Cell Line Info 
Gallus gallus (Chicken)  4
1
EC50 = 42 nM
   TI
   LI
   LO
   TS
2
Kd = 0.52 nM
   TI
   LI
   LO
   TS
3
Kd = 13.5 nM
   TI
   LI
   LO
   TS
4
Kd = 43.6 nM
   TI
   LI
   LO
   TS