BDBM367679 1-(pyridin-2-yl)-N-(pyridin-2-ylmethyl)-N-((1-(3,4,5-trimethoxyphenyl)-1H-1,2,3-triazol-4-yl)methyl)methanamine (OAA4069)::US10227327, Example 5

SMILES COc1cc(cc(OC)c1OC)-n1cc(CN(Cc2ccccn2)Cc2ccccn2)nn1

InChI Key InChIKey=VDJVVTQJHVKGLC-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 367679   

TargetVIM-2 type metallo-beta-lactamase(Pseudomonas aeruginosa)
Universitetet | Oslo

US Patent
LigandPNGBDBM367679(US10227327, Example 5 | 1-(pyridin-2-yl)-N-(pyridi...)
Affinity DataIC50: 1.15E+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
In Depth
Date in BDB:
12/27/2019
Entry Details
Go to US Patent

TargetMetallo-beta-lactamase GIM-1(Pseudomonas aeruginosa)
Universitetet | Oslo

US Patent
LigandPNGBDBM367679(US10227327, Example 5 | 1-(pyridin-2-yl)-N-(pyridi...)
Affinity DataIC50: 790nMAssay 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
In Depth
Date in BDB:
12/27/2019
Entry Details
Go to US Patent