BDBM16421 (2R)-2-hydroxy-2-phenylacetic acid::CHEMBL292411::D-Mandelic acid::R-(-)-Mandelic acid::cid_11914

SMILES O[C@@H](C(O)=O)c1ccccc1

InChI Key InChIKey=IWYDHOAUDWTVEP-SSDOTTSWSA-N

Data  3 KI  2 IC50

PDB links: 5 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 16421   

TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
Medical College of Wiscosin

LigandPNGBDBM16421((2R)-2-hydroxy-2-phenylacetic acid | CHEMBL292411 ...)
Affinity DataKi:  3.61E+5nM ΔG°:  -4.69kcal/molepH: 7.0 T: 2°CAssay Description:The production of NADPH from NADP+ and benzyl alcohol and xylitol was monitored by an increase in NADPH fluorescence (ex: 340 nm; em: 460 nm) using a...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMandelate racemase(Pseudomonas putida (g-Proteobacteria))
Dalhousie University

Curated by ChEMBL
LigandPNGBDBM16421((2R)-2-hydroxy-2-phenylacetic acid | CHEMBL292411 ...)
Affinity DataKi:  5.90E+5nMpH: 7.5Assay Description:Inhibition constant against Mandelate racemase from Pseudomonas putida at pH 7.5More data for this Ligand-Target Pair
TargetMandelate racemase(Pseudomonas putida (g-Proteobacteria))
Dalhousie University

Curated by ChEMBL
LigandPNGBDBM16421((2R)-2-hydroxy-2-phenylacetic acid | CHEMBL292411 ...)
Affinity DataKi:  8.10E+5nMAssay Description:Inhibition of mandelate racemase in Pseudomonas putidaMore data for this Ligand-Target Pair
TargetTyrosine-protein phosphatase non-receptor type 7(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM16421((2R)-2-hydroxy-2-phenylacetic acid | CHEMBL292411 ...)
Affinity DataIC50: >1.00E+5nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetTyrosine-protein phosphatase non-receptor type 1(Homo sapiens (Human))
Brown University

Curated by ChEMBL
LigandPNGBDBM16421((2R)-2-hydroxy-2-phenylacetic acid | CHEMBL292411 ...)
Affinity DataIC50:  5.50E+6nMAssay Description:Inhibitory activity against Yersinia Protein-tyrosine phosphatase 1BMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed