BDBM50078574 CHEMBL46273::inositol 1,4,5-trisphosphate analogue

SMILES O[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)OCCCNC(=O)Oc1ccc2c(Oc3cc(O)ccc3C22OC(=O)c3ccccc23)c1

InChI Key InChIKey=LPRNPGAWQUEBIP-UHFFFAOYSA-N

Data  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50078574   

TargetInositol 1,4,5-trisphosphate receptor type 3(Human)
The University of Tokyo

Curated by ChEMBL
LigandPNGBDBM50078574(inositol 1,4,5-trisphosphate analogue | CHEMBL4627...)
Affinity DataKd:  188nMpH: 7.4Assay Description:Dissociation constant of compound was measured in IP3-binding domain(IBD) of human Inositol 1,4,5-trisphosphate receptor at pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed