BDBM50206817 (2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-((hydroxy(hydroxy(phosphonooxy)phosphoryloxy)phosphoryloxy)methyl)tetrahydrofuran-3-yl 2-(methylamino)benzoate::3'-O-[2-(METHYLAMINO)BENZOYL]ADENOSINE 5'-(TETRAHYDROGEN TRIPHOSPHATE)::CHEMBL254869::MANT-ATP

SMILES CNc1ccccc1C(=O)O[C@@H]2[C@H](O[C@H]([C@@H]2O)n3cnc4c3ncnc4N)CO[P@@](=O)(O)O[P@](=O)(O)OP(=O)(O)O

InChI Key InChIKey=YAPJXKKTHXODSV-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50206817   

TargetCalmodulin-sensitive adenylate cyclase(Bacillus anthracis)
Ernst-Moritz-Arndt-University

Curated by ChEMBL
LigandPNGBDBM50206817(3'-O-[2-(METHYLAMINO)BENZOYL]ADENOSINE 5'-(TETRAHY...)
Affinity DataKi:  980nMAssay Description:Inhibition of Bacillus anthracis edema factor catalytic domain by radiometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/31/2010
Entry Details Article
PubMed