BDBM24725 (adamantan-1-ylmethyl)({2-[(7-chloroquinolin-4-yl)amino]ethyl})amine::4-Aminoquinoline, 20

SMILES Clc1ccc2c(NCCNCC34CC5CC(CC(C5)C3)C4)ccnc2c1

InChI Key InChIKey=XROLUQWWPXRCJD-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 24725   

TargetBotulinum neurotoxin type A2 [1-425](Clostridium botulinum)
University of Belgrade

LigandPNGBDBM24725((adamantan-1-ylmethyl)({2-[(7-chloroquinolin-4-yl)...)
Affinity DataIC50:  1.89E+4nMpH: 7.3 T: 2°CAssay Description:Botox A catalyzed the hydrolysis of substrate peptide between residues 11 (glutamine) and 12 (arginine), corresponding to residues 197 and 198 of SNA...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed