BDBM50023575 4-hydroxy-butyric acid::4-hydroxybutanoic acid::4-hydroxybutyric acid::CHEMBL1342::GHB::Gamma Hydroxybutyric Acid::Xyrem::gamma-hydroxybutyric acid

SMILES OCCCC(O)=O

InChI Key InChIKey=SJZRECIVHVDYJC-UHFFFAOYSA-N

Data  5 KI  2 IC50

PDB links: 313 PDB IDs match this monomer.

  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 7 hits for monomerid = 50023575   

TargetCalcium/calmodulin-dependent protein kinase type II subunit alpha(Rattus norvegicus (rat))
University Of Copenhagen

Curated by ChEMBL
LigandPNGBDBM50023575(4-hydroxy-butyric acid | 4-hydroxybutanoic acid | ...)
Affinity DataKi:  3.00E+3nMAssay Description:Displacement of [3H]HOCPCA from native CaMK2alpha in rat brain cortical membrane homogenates measured after 1 hr by TopCount scintillation counting m...More data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCalcium/calmodulin-dependent protein kinase type II subunit alpha(Rattus norvegicus (rat))
University Of Copenhagen

Curated by ChEMBL
LigandPNGBDBM50023575(4-hydroxy-butyric acid | 4-hydroxybutanoic acid | ...)
Affinity DataKi:  4.30E+3nMAssay Description:Displacement of [3H]NCS-382 from CaMK2alpha in rat brain cortical membrane homogenates measured after 1 hr by TopCount scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCalcium/calmodulin-dependent protein kinase type II subunit alpha(Homo sapiens (Human))
University Of Copenhagen

Curated by ChEMBL
LigandPNGBDBM50023575(4-hydroxy-butyric acid | 4-hydroxybutanoic acid | ...)
Affinity DataKi:  4.30E+3nMAssay Description:Inhibition of [3H]NCS-382 binding to CaMK2alpha (unknown origin)More data for this Ligand-Target Pair
In DepthDetails PubMed
TargetCalcium/calmodulin-dependent protein kinase type II subunit alpha(Rattus norvegicus (rat))
University Of Copenhagen

Curated by ChEMBL
LigandPNGBDBM50023575(4-hydroxy-butyric acid | 4-hydroxybutanoic acid | ...)
Affinity DataKi:  5.10E+4nMAssay Description:Displacement of [3H]HOCPCA from recombinant rat CaMK2alpha expressed in HEK293T cells measured after 1 hr by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetProton-coupled amino acid transporter 1(Homo sapiens (Human))
Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL
LigandPNGBDBM50023575(4-hydroxy-butyric acid | 4-hydroxybutanoic acid | ...)
Affinity DataKi:  6.50E+7nMAssay Description:Inhibition of human PAT1-mediated L-[3H]proline uptake in human Caco2 cells after 10 mins by liquid scintillation countingChecked by AuthorMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGamma-hydroxybutyrate receptor(RAT)
Centre De Neurochimie Du Cnrs

Curated by ChEMBL
LigandPNGBDBM50023575(4-hydroxy-butyric acid | 4-hydroxybutanoic acid | ...)
Affinity DataIC50:  6.60E+3nMAssay Description:Binding affinity towards [3H]-GHB binding siteMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGamma-hydroxybutyrate receptor(RAT)
Centre De Neurochimie Du Cnrs

Curated by ChEMBL
LigandPNGBDBM50023575(4-hydroxy-butyric acid | 4-hydroxybutanoic acid | ...)
Affinity DataIC50:  2.50E+4nMAssay Description:Displacement of [3H]-NCS-382 (16 nM) from GHB receptor of rat cerebrocortical membranesMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed