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Compile Data Set for Download or QSAR

Found 15 hits of kd data for polymerid = 50007297   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50226186
PNG
(4-MP | 4-Methylpyrazole | Antizol | CHEBI:5141 | F...)
Show SMILES Cc1cn[nH]c1
Show InChI InChI=1S/C4H6N2/c1-4-2-5-6-3-4/h2-3H,1H3,(H,5,6)
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n/an/an/a 13n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497144
PNG
(CHEMBL3276276)
Show SMILES ClCCCc1cn[nH]c1
Show InChI InChI=1S/C6H9ClN2/c7-3-1-2-6-4-8-9-5-6/h4-5H,1-3H2,(H,8,9)
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n/an/an/a 20n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50390969
PNG
(PYRAZOLE)
Show SMILES c1cn[nH]c1
Show InChI InChI=1S/C3H4N2/c1-2-4-5-3-1/h1-3H,(H,4,5)
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CHEBI
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PubMed
n/an/an/a 200n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497147
PNG
(CHEMBL3276275)
Show SMILES OCCCc1cn[nH]c1
Show InChI InChI=1S/C6H10N2O/c9-3-1-2-6-4-7-8-5-6/h4-5,9H,1-3H2,(H,7,8)
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n/an/an/a 560n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497143
PNG
(CHEMBL3276274)
Show SMILES OCCc1cn[nH]c1
Show InChI InChI=1S/C5H8N2O/c8-2-1-5-3-6-7-4-5/h3-4,8H,1-2H2,(H,6,7)
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PC cid
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n/an/an/a 770n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497142
PNG
(CHEMBL3276273)
Show SMILES ClCc1cn[nH]c1
Show InChI InChI=1S/C4H5ClN2/c5-1-4-2-6-7-3-4/h2-3H,1H2,(H,6,7)
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n/an/an/a 2.70E+3n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497138
PNG
(CHEMBL3276272)
Show SMILES OCc1cn[nH]c1
Show InChI InChI=1S/C4H6N2O/c7-3-4-1-5-6-2-4/h1-2,7H,3H2,(H,5,6)
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n/an/an/a 3.60E+3n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497141
PNG
(CHEMBL3275950)
Show SMILES ClCCCc1cc[nH]n1
Show InChI InChI=1S/C6H9ClN2/c7-4-1-2-6-3-5-8-9-6/h3,5H,1-2,4H2,(H,8,9)
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n/an/an/a 4.00E+4n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497148
PNG
(CHEMBL3275949)
Show SMILES OCCCc1cc[nH]n1
Show InChI InChI=1S/C6H10N2O/c9-5-1-2-6-3-4-7-8-6/h3-4,9H,1-2,5H2,(H,7,8)
PDB

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PubMed
n/an/an/a 6.00E+4n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497139
PNG
(CHEMBL3275944)
Show SMILES Cc1cc[nH]n1
Show InChI InChI=1S/C4H6N2/c1-4-2-3-5-6-4/h2-3H,1H3,(H,5,6)
PDB

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n/an/an/a 1.25E+5n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497137
PNG
(CHEMBL3275945)
Show SMILES OCc1cc[nH]n1
Show InChI InChI=1S/C4H6N2O/c7-3-4-1-2-5-6-4/h1-2,7H,3H2,(H,5,6)
PDB

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PC cid
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PubMed
n/an/an/a 1.50E+5n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497145
PNG
(CHEMBL3275947)
Show SMILES OCCc1cc[nH]n1
Show InChI InChI=1S/C5H8N2O/c8-4-2-5-1-3-6-7-5/h1,3,8H,2,4H2,(H,6,7)
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 1.70E+5n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497140
PNG
(CHEMBL3275948)
Show SMILES ClCCc1cc[nH]n1
Show InChI InChI=1S/C5H7ClN2/c6-3-1-5-2-4-7-8-5/h2,4H,1,3H2,(H,7,8)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 2.00E+5n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50497146
PNG
(CHEMBL3275951)
Show SMILES CC(=O)c1cc[nH]n1
Show InChI InChI=1S/C5H6N2O/c1-4(8)5-2-3-6-7-5/h2-3H,1H3,(H,6,7)
PDB

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PC cid
PC sid
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Article
PubMed
n/an/an/a 5.10E+6n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair
Alcohol dehydrogenase S chain


(Equus caballus)
BDBM50132132
PNG
(1H-pyrazole-3-carboxylic acid | CHEMBL128679)
Show SMILES OC(=O)c1ccn[nH]1
Show InChI InChI=1S/C4H4N2O2/c7-4(8)3-1-2-5-6-3/h1-2H,(H,5,6)(H,7,8)
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Article
PubMed
n/an/an/a 6.50E+6n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of horse liver alcohol dehydrogenase using ethanol as substrate assessed as dissociation constant by spectrophotometric titration in prese...


J Med Chem 22: 356-9 (1979)


Article DOI: 10.1021/jm00190a005
BindingDB Entry DOI: 10.7270/Q26T0QNZ
More data for this
Ligand-Target Pair