BDBM22919 1-[1-hydroxy-4-(naphthalen-1-yl)butan-2-yl]-1H-imidazole-4-carboxamide::CHEMBL327830::FR230513::imidazole-4-carboxamide derivative, 3

SMILES c1ccc2c(c1)cccc2CC[C@H](CO)n3cc(nc3)C(=O)N

InChI Key InChIKey=URGFTPMACWKJKU-UHFFFAOYSA-N

Data  2 KI  1 IC50

PDB links: 1 PDB ID matches this monomer.

  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 3 hits for monomerid = 22919   

TargetAdenosine deaminase(Human)
Fujisawa Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM22919(CHEMBL327830 | imidazole-4-carboxamide derivative,...)
Affinity DataIC50: 570nMAssay Description:Inhibitory concentration against adenosine deaminaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetAdenosine deaminase(Human)
Fujisawa Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM22919(CHEMBL327830 | imidazole-4-carboxamide derivative,...)
Affinity DataKi:  680nM ΔG°:  -8.32kcal/molepH: 7.4 T: 2°CAssay Description:The reaction velocity was measured by change in absorbance at 265nm (A265) resulting from the deamination of adenosine. The reaction was started by a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/29/2008
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetAdenosine deaminase(Human)
Fujisawa Pharmaceutical

Curated by ChEMBL
LigandPNGBDBM22919(CHEMBL327830 | imidazole-4-carboxamide derivative,...)
Affinity DataKi:  680nMAssay Description:Binding affinity towards adenosine deaminaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMedPDB3D3D Structure (crystal)