BDBM367683 1-(1-β-bromo-4-methoxybenzyl)-1H-1,2,3-triazol-4-yl)-N,N-bis(pyridin-2-ylmethyl)methanamine (OAA4077)::US10227327, Example 9

SMILES COc1ccc(Cn2cc(CN(Cc3ccccn3)Cc3ccccn3)nn2)cc1Br

InChI Key InChIKey=MDHPIWJVALCTKT-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 367683   

TargetMetallo-beta-lactamase type 2(Klebsiella pneumoniae)
Universitetet | Oslo

US Patent
LigandPNGBDBM367683(1-(1-β-bromo-4-methoxybenzyl)-1H-1,2,3-triazo...)
Affinity DataIC50:  600nMAssay Description:a. Transfer 50 μl LB with 0.8 mM IPTG (0.4 mM final concentration in assay) to each wellb. Add 1 μl inhibitor/positive control (500/1000 &#...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetMetallo-beta-lactamase GIM-1(Pseudomonas aeruginosa)
Universitetet | Oslo

US Patent
LigandPNGBDBM367683(1-(1-β-bromo-4-methoxybenzyl)-1H-1,2,3-triazo...)
Affinity DataIC50:  3.15E+3nMAssay Description:a. Transfer 50 μl LB with 0.8 mM IPTG (0.4 mM final concentration in assay) to each wellb. Add 1 μl inhibitor/positive control (500/1000 &#...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetVIM-2 type metallo-beta-lactamase(Pseudomonas aeruginosa)
Universitetet | Oslo

US Patent
LigandPNGBDBM367683(1-(1-β-bromo-4-methoxybenzyl)-1H-1,2,3-triazo...)
Affinity DataIC50:  1.90E+4nMAssay Description:a. Transfer 50 μl LB with 0.8 mM IPTG (0.4 mM final concentration in assay) to each wellb. Add 1 μl inhibitor/positive control (500/1000 &#...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent