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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 405.4
BDBM372647

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Voltage-dependent T-type calcium channel subunit alpha-1H


(Homo sapiens (Human))
BDBM372647
PNG
(N-[2-(3-Cyano-4-methyl-benzyl)-2H-[1,2,3]triazol-4...)
Show SMILES Cc1ccc(Cn2ncc(NC(=O)Cc3ccc(cc3)C3(F)COC3)n2)cc1C#N
Show InChI InChI=1S/C22H20FN5O2/c1-15-2-3-17(8-18(15)10-24)12-28-25-11-20(27-28)26-21(29)9-16-4-6-19(7-5-16)22(23)13-30-14-22/h2-8,11H,9,12-14H2,1H3,(H,26,27,29)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 310n/an/an/an/an/an/a



University of Alberta



Assay Description
Stock solutions of test compounds are prepared to a concentration of 10 mM in DMSO. For the Cav3.2 assay, serial dilutions of the compounds are prepa...


J Med Chem 49: 1668-83 (2006)


BindingDB Entry DOI: 10.7270/Q2794709
More data for this
Ligand-Target Pair