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3 similar compounds to monomer 50342237

Wt: 407.3
BDBM50342234
Wt: 421.3
BDBM50342235
Wt: 437.3
BDBM50342236

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50342234,50342235,50342236   
Target
(Institution)
LigandTarget
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
Secreted effector protein


(Yersinia pestis)
BDBM50342234
PNG
(CHEMBL1766709 | difluoro(4'-((furan-2-ylmethylenea...)
Show SMILES OP(O)(=O)C(F)(F)c1cccc(c1)-c1ccc(CO\N=C\c2ccco2)cc1
Show InChI InChI=1S/C19H16F2NO5P/c20-19(21,28(23,24)25)17-4-1-3-16(11-17)15-8-6-14(7-9-15)13-27-22-12-18-5-2-10-26-18/h1-12H,13H2,(H2,23,24,25)/b22-12+
PDB
MMDB

KEGG

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



NCI-Frederick

Curated by ChEMBL


Assay Description
Inhibition of Yersinia pestis outer protein H expressed in Escherichia coli after 15 to 20 mins


J Med Chem 54: 2933-43 (2011)

More data for this
Ligand-Target Pair
Secreted effector protein


(Yersinia pestis)
BDBM50342236
PNG
(CHEMBL1766711 | difluoro(4'-(((5-(hydroxymethyl)fu...)
Show SMILES OCc1ccc(\C=N\OCc2ccc(cc2)-c2cccc(c2)C(F)(F)P(O)(O)=O)o1
Show InChI InChI=1S/C20H18F2NO6P/c21-20(22,30(25,26)27)17-3-1-2-16(10-17)15-6-4-14(5-7-15)13-28-23-11-18-8-9-19(12-24)29-18/h1-11,24H,12-13H2,(H2,25,26,27)/b23-11+
PDB
MMDB

KEGG

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 730n/an/an/an/an/an/a



NCI-Frederick

Curated by ChEMBL


Assay Description
Inhibition of Yersinia pestis outer protein H expressed in Escherichia coli after 15 to 20 mins


J Med Chem 54: 2933-43 (2011)

More data for this
Ligand-Target Pair
Secreted effector protein


(Yersinia pestis)
BDBM50342235
PNG
(CHEMBL1766710 | difluoro(4'-(((5-methylfuran-2-yl)...)
Show SMILES Cc1ccc(\C=N\OCc2ccc(cc2)-c2cccc(c2)C(F)(F)P(O)(O)=O)o1
Show InChI InChI=1S/C20H18F2NO5P/c1-14-5-10-19(28-14)12-23-27-13-15-6-8-16(9-7-15)17-3-2-4-18(11-17)20(21,22)29(24,25)26/h2-12H,13H2,1H3,(H2,24,25,26)/b23-12+
PDB
MMDB

KEGG

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 910n/an/an/an/an/an/a



NCI-Frederick

Curated by ChEMBL


Assay Description
Inhibition of Yersinia pestis outer protein H expressed in Escherichia coli after 15 to 20 mins


J Med Chem 54: 2933-43 (2011)

More data for this
Ligand-Target Pair