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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 188.2
BDBM50473190

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
Nischarin


(Homo sapiens (Human))
BDBM50473190
PNG
(CHEMBL269198)
Show SMILES Cc1ccc(cc1)C1=NCCCCN1 |t:8|
Show InChI InChI=1S/C12H16N2/c1-10-4-6-11(7-5-10)12-13-8-2-3-9-14-12/h4-7H,2-3,8-9H2,1H3,(H,13,14)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.00E+4n/an/an/an/an/an/an/an/a



Universit£ d'Orl£ans

Curated by ChEMBL


Assay Description
Binding affinity for imidazoline receptor I-2 in rabbit kidney homogenate (relative to [3H]-Idazoxan radioligand)


J Med Chem 43: 1109-22 (2000)


Article DOI: 10.1021/jm991124t
BindingDB Entry DOI: 10.7270/Q2SB48G9
More data for this
Ligand-Target Pair