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Found 21 hits Enz. Inhib. hit(s) with Target = 'Gamma hydroxybutyric, GHB' AND taxid = 10116   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Gamma hydroxybutyric, GHB


(RAT)
BDBM86149
PNG
(CAS_131413 | NCS-382 | NSC_131413)
Show SMILES OC1c2ccccc2CCC\C1=C\C([O-])=O
Show InChI InChI=1S/C13H14O3/c14-12(15)8-10-6-3-5-9-4-1-2-7-11(9)13(10)16/h1-2,4,7-8,13,16H,3,5-6H2,(H,14,15)/p-1/b10-8-
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1.80E+3n/an/an/an/an/an/an/an/a



University of Maryland

Curated by PDSP Ki Database




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More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM86151
PNG
(UMB68)
Show SMILES CC(C)(O)CCC([O-])=O
Show InChI InChI=1S/C6H12O3/c1-6(2,9)4-3-5(7)8/h9H,3-4H2,1-2H3,(H,7,8)/p-1
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Maryland

Curated by PDSP Ki Database




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More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM86152
PNG
(UMB75)
Show SMILES CC(C)(O)CCCC([O-])=O
Show InChI InChI=1S/C7H14O3/c1-7(2,10)5-3-4-6(8)9/h10H,3-5H2,1-2H3,(H,8,9)/p-1
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Maryland

Curated by PDSP Ki Database




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More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM86150
PNG
(UMB58)
Show SMILES OCCCCC([O-])=O
Show InChI InChI=1S/C5H10O3/c6-4-2-1-3-5(7)8/h6H,1-4H2,(H,7,8)/p-1
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Maryland

Curated by PDSP Ki Database




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Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50023573
PNG
(4-Cyclohexyl-4-hydroxy-but-2-enoic acid | CHEMBL17...)
Show SMILES OC(\C=C\C(O)=O)C1CCCCC1
Show InChI InChI=1S/C10H16O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h6-9,11H,1-5H2,(H,12,13)/b7-6+
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n/an/a 3.30n/an/an/an/an/an/a



Centre de Neurochimie du CNRS

Curated by ChEMBL


Assay Description
Binding affinity towards [3H]-GHB binding site


J Med Chem 31: 893-7 (1988)

More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50023572
PNG
(CHEMBL354804 | Sodium; 4-hydroxy-but-2-enoate)
Show SMILES OC\C=C\C([O-])=O
Show InChI InChI=1S/C4H6O3/c5-3-1-2-4(6)7/h1-2,5H,3H2,(H,6,7)/p-1/b2-1+
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n/an/a 3.5n/an/an/an/an/an/a



Centre de Neurochimie du CNRS

Curated by ChEMBL


Assay Description
Binding affinity towards [3H]-GHB binding site


J Med Chem 31: 893-7 (1988)

More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50023574
PNG
(4-Hydroxy-pent-2-enoic acid | CHEMBL171595)
Show SMILES CC(O)\C=C\C(O)=O
Show InChI InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-4,6H,1H3,(H,7,8)/b3-2+
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n/an/a 11n/an/an/an/an/an/a



Centre de Neurochimie du CNRS

Curated by ChEMBL


Assay Description
Binding affinity towards [3H]-GHB binding site


J Med Chem 31: 893-7 (1988)

More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50246038
PNG
((R)-2-(5-hydroxy-8,9-dihydro-5H-benzo[7]annulen-6(...)
Show SMILES O[C@H]1c2ccccc2CCC\C1=C/C(O)=O
Show InChI InChI=1S/C13H14O3/c14-12(15)8-10-6-3-5-9-4-1-2-7-11(9)13(10)16/h1-2,4,7-8,13,16H,3,5-6H2,(H,14,15)/b10-8+/t13-/m1/s1
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n/an/a 400n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]SUC from succinic acid binding site of gamma-hydroxybutyrate receptor in rat forebrain synaptic membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50246040
PNG
((E,RS)-(6,7,8,9-tetrahydro-5-hydroxy-5H-benzocyclo...)
Show SMILES OC1c2ccccc2CCC\C1=C/C(O)=O
Show InChI InChI=1S/C13H14O3/c14-12(15)8-10-6-3-5-9-4-1-2-7-11(9)13(10)16/h1-2,4,7-8,13,16H,3,5-6H2,(H,14,15)/b10-8+
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n/an/a 500n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]SUC from succinic acid binding site of gamma-hydroxybutyrate receptor in rat forebrain synaptic membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50246038
PNG
((R)-2-(5-hydroxy-8,9-dihydro-5H-benzo[7]annulen-6(...)
Show SMILES O[C@H]1c2ccccc2CCC\C1=C/C(O)=O
Show InChI InChI=1S/C13H14O3/c14-12(15)8-10-6-3-5-9-4-1-2-7-11(9)13(10)16/h1-2,4,7-8,13,16H,3,5-6H2,(H,14,15)/b10-8+/t13-/m1/s1
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n/an/a 800n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]GHB from gamma-hydroxybutyrate binding site of gamma-hydroxybutyrate receptor in rat forebrain synaptic membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50246040
PNG
((E,RS)-(6,7,8,9-tetrahydro-5-hydroxy-5H-benzocyclo...)
Show SMILES OC1c2ccccc2CCC\C1=C/C(O)=O
Show InChI InChI=1S/C13H14O3/c14-12(15)8-10-6-3-5-9-4-1-2-7-11(9)13(10)16/h1-2,4,7-8,13,16H,3,5-6H2,(H,14,15)/b10-8+
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n/an/a 900n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]GHB from gamma-hydroxybutyrate binding site of gamma-hydroxybutyrate receptor in rat forebrain synaptic membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50168281
PNG
(CHEMBL189853 | [3-(3-Phenyl-propoxy)-phenyl]-aceti...)
Show SMILES OC(=O)Cc1cccc(OCCCc2ccccc2)c1
Show InChI InChI=1S/C17H18O3/c18-17(19)13-15-8-4-10-16(12-15)20-11-5-9-14-6-2-1-3-7-14/h1-4,6-8,10,12H,5,9,11,13H2,(H,18,19)
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n/an/a 4.50E+3n/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]-NCS-382 (16 nM) from GHB receptor of rat cerebrocortical membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50023575
PNG
(4-hydroxy-butyric acid | 4-hydroxybutanoic acid | ...)
Show SMILES OCCCC(O)=O
Show InChI InChI=1S/C4H8O3/c5-3-1-2-4(6)7/h5H,1-3H2,(H,6,7)
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n/an/a 6.60E+3n/an/an/an/an/an/a



Centre de Neurochimie du CNRS

Curated by ChEMBL


Assay Description
Binding affinity towards [3H]-GHB binding site


J Med Chem 31: 893-7 (1988)

More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50168285
PNG
((3-Phenethyloxy-phenyl)-acetic acid | CHEMBL190961)
Show SMILES OC(=O)Cc1cccc(OCCc2ccccc2)c1
Show InChI InChI=1S/C16H16O3/c17-16(18)12-14-7-4-8-15(11-14)19-10-9-13-5-2-1-3-6-13/h1-8,11H,9-10,12H2,(H,17,18)
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n/an/a 8.30E+3n/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]-NCS-382 (16 nM) from GHB receptor of rat cerebrocortical membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50168283
PNG
((3-hydroxyphenyl)acetic acid | (m-hydroxyphenyl)ac...)
Show SMILES OC(=O)Cc1cccc(O)c1
Show InChI InChI=1S/C8H8O3/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)
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n/an/a 1.20E+4n/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]-NCS-382 (16 nM) from GHB receptor of rat cerebrocortical membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50060976
PNG
((3-Phenoxy-phenyl)-acetic acid | CHEMBL107066)
Show SMILES OC(=O)Cc1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C14H12O3/c15-14(16)10-11-5-4-8-13(9-11)17-12-6-2-1-3-7-12/h1-9H,10H2,(H,15,16)
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n/an/a 1.63E+4n/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]-NCS-382 (16 nM) from GHB receptor of rat cerebrocortical membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50023575
PNG
(4-hydroxy-butyric acid | 4-hydroxybutanoic acid | ...)
Show SMILES OCCCC(O)=O
Show InChI InChI=1S/C4H8O3/c5-3-1-2-4(6)7/h5H,1-3H2,(H,6,7)
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n/an/a 2.50E+4n/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]-NCS-382 (16 nM) from GHB receptor of rat cerebrocortical membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50168282
PNG
((3-Benzyloxy-phenyl)-acetic acid | CHEMBL190962)
Show SMILES OC(=O)Cc1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C15H14O3/c16-15(17)10-13-7-4-8-14(9-13)18-11-12-5-2-1-3-6-12/h1-9H,10-11H2,(H,16,17)
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n/an/a 4.60E+4n/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]-NCS-382 (16 nM) from GHB receptor of rat cerebrocortical membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50246039
PNG
((S,E)-2-(5-hydroxy-8,9-dihydro-5H-benzo[7]annulen-...)
Show SMILES O[C@@H]1c2ccccc2CCC\C1=C/C(O)=O
Show InChI InChI=1S/C13H14O3/c14-12(15)8-10-6-3-5-9-4-1-2-7-11(9)13(10)16/h1-2,4,7-8,13,16H,3,5-6H2,(H,14,15)/b10-8+/t13-/m0/s1
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n/an/a 7.40E+4n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]SUC from succinic acid binding site of gamma-hydroxybutyrate receptor in rat forebrain synaptic membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50246039
PNG
((S,E)-2-(5-hydroxy-8,9-dihydro-5H-benzo[7]annulen-...)
Show SMILES O[C@@H]1c2ccccc2CCC\C1=C/C(O)=O
Show InChI InChI=1S/C13H14O3/c14-12(15)8-10-6-3-5-9-4-1-2-7-11(9)13(10)16/h1-2,4,7-8,13,16H,3,5-6H2,(H,14,15)/b10-8+/t13-/m0/s1
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n/an/a 9.30E+4n/an/an/an/an/an/a



Hungarian Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]GHB from gamma-hydroxybutyrate binding site of gamma-hydroxybutyrate receptor in rat forebrain synaptic membranes


Citation and Details
More data for this
Ligand-Target Pair
Gamma hydroxybutyric, GHB


(RAT)
BDBM50168284
PNG
(4-Phenoxy-butyric acid | CHEMBL190723)
Show SMILES OC(=O)CCCOc1ccccc1
Show InChI InChI=1S/C10H12O3/c11-10(12)7-4-8-13-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)
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n/an/a 2.10E+5n/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]-NCS-382 (16 nM) from GHB receptor of rat cerebrocortical membranes


Citation and Details
More data for this
Ligand-Target Pair