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BDBM50450911 CHEMBL4218889

SMILES: Oc1ccc(\C=C(/C#N)c2nc3ccccc3s2)c(O)c1

InChI Key: InChIKey=DUANVZFOXHANPF-YRNVUSSQSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50450911   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Probable L-lysine-epsilon aminotransferase


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50450911
PNG
(CHEMBL4218889)
Show SMILES Oc1ccc(\C=C(/C#N)c2nc3ccccc3s2)c(O)c1
Show InChI InChI=1S/C16H10N2O2S/c17-9-11(7-10-5-6-12(19)8-14(10)20)16-18-13-3-1-2-4-15(13)21-16/h1-8,19-20H/b11-7+
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.32E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis LAT using L-lysine as substrate by spectroscopic method


Bioorg Med Chem 25: 2761-2771 (2017)


Article DOI: 10.1016/j.bmc.2017.03.053
BindingDB Entry DOI: 10.7270/Q2J67KGM
More data for this
Ligand-Target Pair