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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Fibonectin-binding protein C' and Monomerid = 50148588   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Fibonectin-binding protein C


(Mycobacterium tuberculosis)
BDBM50148588
PNG
(CHEMBL325304 | Heptyl-phosphonic acid monoethyl es...)
Show SMILES CCCCCCCP(O)(=O)OCC
Show InChI InChI=1S/C9H21O3P/c1-3-5-6-7-8-9-13(10,11)12-4-2/h3-9H2,1-2H3,(H,10,11)
PDB
MMDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.06E+3n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis


Bioorg Med Chem Lett 14: 3559-62 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.052
BindingDB Entry DOI: 10.7270/Q2C828RQ
More data for this
Ligand-Target Pair
Fibonectin-binding protein C


(Mycobacterium tuberculosis)
BDBM50148588
PNG
(CHEMBL325304 | Heptyl-phosphonic acid monoethyl es...)
Show SMILES CCCCCCCP(O)(=O)OCC
Show InChI InChI=1S/C9H21O3P/c1-3-5-6-7-8-9-13(10,11)12-4-2/h3-9H2,1-2H3,(H,10,11)
PDB
MMDB

KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase


Eur J Med Chem 42: 54-63 (2007)


Article DOI: 10.1016/j.ejmech.2006.08.007
BindingDB Entry DOI: 10.7270/Q2F18ZB3
More data for this
Ligand-Target Pair