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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 360.5
BDBM50387728

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
Natural resistance-associated macrophage protein 1


(Homo sapiens (Human))
BDBM50387728
PNG
(CHEMBL2058880)
Show SMILES NC(=N)SCc1cccc2c1sc1c(CSC(N)=N)cccc21
Show InChI InChI=1S/C16H16N4S3/c17-15(18)21-7-9-3-1-5-11-12-6-2-4-10(8-22-16(19)20)14(12)23-13(9)11/h1-6H,7-8H2,(H3,17,18)(H3,19,20)
Reactome pathway
KEGG

UniProtKB/SwissProt

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



Xenon Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of NRAMP1 expressed in CHO cells


Bioorg Med Chem Lett 22: 5108-13 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.129
BindingDB Entry DOI: 10.7270/Q2QN67TM
More data for this
Ligand-Target Pair