BDBM50170809 (1R,4R,5R)-1,4,5-Trihydroxy-3-(3-nitro-phenyl)-cyclohex-2-enecarboxylic acid::CHEMBL188524

SMILES O[C@@H]1C[C@@](O)(C=C([C@H]1O)c1cccc(c1)[N+]([O-])=O)C(O)=O

InChI Key InChIKey=AZKBVJLQNQFBRJ-WZRBSPASSA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50170809   

Target3-dehydroquinate dehydratase(Mycobacterium tuberculosis)
Universidad De Santiago De Compostela

Curated by ChEMBL
LigandPNGBDBM50170809((1R,4R,5R)-1,4,5-Trihydroxy-3-(3-nitro-phenyl)-cyc...)
Affinity DataKi:  54nMAssay Description:Competitive inhibition of Mycobacterium tuberculosis DHQ2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
Target3-dehydroquinate dehydratase(Mycobacterium tuberculosis)
Universidad De Santiago De Compostela

Curated by ChEMBL
LigandPNGBDBM50170809((1R,4R,5R)-1,4,5-Trihydroxy-3-(3-nitro-phenyl)-cyc...)
Affinity DataKi:  54nMpH: 8.2Assay Description:Inhibition of Mycobacterium tuberculosis type II dehydroquinase at 25 degree C pH 8.2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed