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SMILES: Cc1cccn2c(cnc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O

InChI Key: InChIKey=HZPJCVFFDAMKRH-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 262287   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Metallo-beta-lactamase type 2


(Serratia marcescens)
BDBM262287
PNG
(3-(8-methylimidazo[1,2-a] pyridin-3-yl)-2-(1H- tet...)
Show SMILES Cc1cccn2c(cnc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O
Show InChI InChI=1S/C15H13N7O2S/c1-9-4-3-7-22-11(8-17-15(9)22)10-5-2-6-12(25(16,23)24)13(10)14-18-20-21-19-14/h2-8H,1H3,(H2,16,23,24)(H,18,19,20,21)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 98.4n/an/an/an/a7.0n/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The Class B enzyme activities were measured in the presence of the test inhibitor in a fluorescence assay against a commercially available substrate ...


US Patent US9708336 (2017)


BindingDB Entry DOI: 10.7270/Q2FN186K
More data for this
Ligand-Target Pair
VIM-1 metallo-beta-lactamase


(Klebsiella pneumoniae)
BDBM262287
PNG
(3-(8-methylimidazo[1,2-a] pyridin-3-yl)-2-(1H- tet...)
Show SMILES Cc1cccn2c(cnc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O
Show InChI InChI=1S/C15H13N7O2S/c1-9-4-3-7-22-11(8-17-15(9)22)10-5-2-6-12(25(16,23)24)13(10)14-18-20-21-19-14/h2-8H,1H3,(H2,16,23,24)(H,18,19,20,21)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.78n/an/an/an/a7.0n/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The Class B enzyme activities were measured in the presence of the test inhibitor in a fluorescence assay against a commercially available substrate ...


US Patent US9708336 (2017)


BindingDB Entry DOI: 10.7270/Q2FN186K
More data for this
Ligand-Target Pair
Metallo-beta-lactamase type 2


(Klebsiella pneumoniae)
BDBM262287
PNG
(3-(8-methylimidazo[1,2-a] pyridin-3-yl)-2-(1H- tet...)
Show SMILES Cc1cccn2c(cnc12)-c1cccc(c1-c1nnn[nH]1)S(N)(=O)=O
Show InChI InChI=1S/C15H13N7O2S/c1-9-4-3-7-22-11(8-17-15(9)22)10-5-2-6-12(25(16,23)24)13(10)14-18-20-21-19-14/h2-8H,1H3,(H2,16,23,24)(H,18,19,20,21)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.637n/an/an/an/a7.0n/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The Class B enzyme activities were measured in the presence of the test inhibitor in a fluorescence assay against a commercially available substrate ...


US Patent US9708336 (2017)


BindingDB Entry DOI: 10.7270/Q2FN186K
More data for this
Ligand-Target Pair