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BDBM50343348 2-Cyclopentyl-1-[4-(3-thiophen-2-yl-[1,2,4]oxadiazol-5-yl)-piperidin-1-yl]-ethanone::CHEMBL1773961

SMILES: O=C(CC1CCCC1)N1CCC(CC1)c1nc(no1)-c1cccs1

InChI Key: InChIKey=LMLBJKHEALDLPO-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50343348   
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
Transcriptional repressor EthR (EthR)


(Mycobacterium tuberculosis)		BDBM50343348
PNG
(2-Cyclopentyl-1-[4-(3-thiophen-2-yl-[1,2,4]oxadiaz...)
Show SMILES O=C(CC1CCCC1)N1CCC(CC1)c1nc(no1)-c1cccs1
Show InChI InChI=1S/C18H23N3O2S/c22-16(12-13-4-1-2-5-13)21-9-7-14(8-10-21)18-19-17(20-23-18)15-6-3-11-24-15/h3,6,11,13-14H,1-2,4-5,7-10,12H2
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PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis EthR interaction to ethA promoter after 5 mins by surface plasmon resonance assay

J Med Chem 54: 2994-3010 (2011)


Article DOI: 10.1021/jm200076a
BindingDB Entry DOI: 10.7270/Q2SJ1KXS
More data for this
Ligand-Target Pair