BDBM36301 2-Chlorophenol (2-CP)::2-chlorophenol

SMILES Oc1ccccc1Cl

InChI Key InChIKey=ISPYQTSUDJAMAB-UHFFFAOYSA-N

Data  1 Kd  1 EC50  1 ITC

PDB links: 4 PDB IDs match this monomer.

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 36301   

TargetPentachlorophenol 4-monooxygenase(Sphingobium chlorophenolicum)
University of Colorado Boulder

LigandPNGBDBM36301(2-Chlorophenol (2-CP) | 2-chlorophenol)
Affinity DataKd: >1.00E+6nMAssay Description:Formation of the hydroxylated product and depletion of NADPH were measured following ethyl acetate extraction of the reaction mixture.More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetTransient receptor potential cation channel subfamily A member 1(Human)
Kyoto University Shogoin-Kawaharacho

Curated by ChEMBL
LigandPNGBDBM36301(2-Chlorophenol (2-CP) | 2-chlorophenol)
Affinity DataEC50:  5.01E+5nMAssay Description:Agonist activity at TRPA1 (unknown origin) by calcium imaging assayMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 36301   

HostPNGBDBM36284(SAMPL3, H3 | BDBM36303 | Methyl Viologen-Cucurbit[...)
University of Cambridge

GuestPNGBDBM36301(2-Chlorophenol (2-CP) | 2-chlorophenol)
ITC DataΔG°: -6.67kcal/mole logk: 7.90E+4
pH: 7.0 T: 25.00°C