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BDBM113794 6-(Cyano(4-fluorophenyl)methyl)-3-methylpicolinonitrile (26)

SMILES: Cc1ccc(nc1C#N)C(C#N)c1ccc(F)cc1

InChI Key: InChIKey=XXVIZEBGVUMEEY-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 113794   
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
PvdQ


(Pseudomonas aeruginosa)
BDBM113794
PNG
(6-(Cyano(4-fluorophenyl)methyl)-3-methylpicolinoni...)
Show SMILES Cc1ccc(nc1C#N)C(C#N)c1ccc(F)cc1
Show InChI InChI=1S/C15H10FN3/c1-10-2-7-14(19-15(10)9-18)13(8-17)11-3-5-12(16)6-4-11/h2-7,13H,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 130n/an/an/an/an/an/a



The Broad Institute , Cambridge, Massachusetts 02142, United States



Assay Description
The assay was performed with nine compound concentrations that ranged from 3 nM to 19.5 µM with PvdQ concentration of 20 nM. The positive contro...


ACS Chem Biol 9: 1536-44 (2014)


Article DOI: 10.1021/cb5001586
BindingDB Entry DOI: 10.7270/Q2PC311M
More data for this
Ligand-Target Pair