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BDBM50528093 CHEMBL4550592

SMILES: Cc1cccc(c1)C(=O)CN1C(=O)NC(C)(C1=O)c1ccc(cc1)C#N

InChI Key: InChIKey=CGGVRUKIDCMNFQ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50528093   
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
Decaprenylphosphoryl-beta-D-ribose oxidase


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)		BDBM50528093
PNG
(CHEMBL4550592)
Show SMILES Cc1cccc(c1)C(=O)CN1C(=O)NC(C)(C1=O)c1ccc(cc1)C#N
Show InChI InChI=1S/C20H17N3O3/c1-13-4-3-5-15(10-13)17(24)12-23-18(25)20(2,22-19(23)26)16-8-6-14(11-21)7-9-16/h3-10H,12H2,1-2H3,(H,22,26)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis DprE1 expressed in Escherichia coli BL21(DE3) cells

J Med Chem 63: 5367-5386 (2020)


Article DOI: 10.1021/acs.jmedchem.0c00107
More data for this
Ligand-Target Pair