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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50315607   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
LmbE-related protein


(Mycobacterium tuberculosis)
BDBM50315607
PNG
(CHEMBL1093143 | Phenyl-2-deoxy-2-[3'-(8''-hydroxy-...)
Show SMILES Cc1c(O)c2cccc(O)c2c(O)c1C=CCCCC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1Sc1ccccc1
Show InChI InChI=1S/C29H33NO8S/c1-16-18(26(35)23-19(25(16)34)12-8-13-20(23)32)11-6-3-7-14-22(33)30-24-28(37)27(36)21(15-31)38-29(24)39-17-9-4-2-5-10-17/h2,4-6,8-13,21,24,27-29,31-32,34-37H,3,7,14-15H2,1H3,(H,30,33)/t21-,24-,27-,28-,29-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.68E+4n/an/an/an/an/an/an/an/a



University of Cape Town

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis MshB expressed in Escherichia coli BL21 after 10 mins by HPLC analysis


Bioorg Med Chem 18: 2501-14 (2010)


Article DOI: 10.1016/j.bmc.2010.02.049
BindingDB Entry DOI: 10.7270/Q2JH3M9C
More data for this
Ligand-Target Pair