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Compile Data Set for Download or QSAR

Found 5 hits of ki for monomerid = 50064266   
Target/Host
(Institution)
LigandTarget/Host
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
All-trans-retinol dehydrogenase [NAD(+)] ADH1B


(Homo sapiens (Human))
BDBM50064266
PNG
(CHEMBL43719 | HEPTYLFORMAMIDE | N-Heptyl-formamide)
Show SMILES CCCCCCCNC=O
Show InChI InChI=1S/C8H17NO/c1-2-3-4-5-6-7-9-8-10/h8H,2-7H2,1H3,(H,9,10)
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330n/an/an/an/an/an/an/an/a



The University of Iowa

Curated by ChEMBL


Assay Description
Inhibition of human alcohol dehydrogenase beta 1 activity


J Med Chem 41: 1696-701 (1998)


Article DOI: 10.1021/jm9707380
BindingDB Entry DOI: 10.7270/Q2VM4BC5
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
All-trans-retinol dehydrogenase [NAD(+)] ADH7


(Homo sapiens (Human))
BDBM50064266
PNG
(CHEMBL43719 | HEPTYLFORMAMIDE | N-Heptyl-formamide)
Show SMILES CCCCCCCNC=O
Show InChI InChI=1S/C8H17NO/c1-2-3-4-5-6-7-9-8-10/h8H,2-7H2,1H3,(H,9,10)
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Article
PubMed
740n/an/an/an/an/an/an/an/a



The University of Iowa

Curated by ChEMBL


Assay Description
Inhibition of human alcohol dehydrogenase sigma activity


J Med Chem 41: 1696-701 (1998)


Article DOI: 10.1021/jm9707380
BindingDB Entry DOI: 10.7270/Q2VM4BC5
More data for this
Ligand-Target Pair
Alcohol dehydrogenase 1A


(Homo sapiens (Human))
BDBM50064266
PNG
(CHEMBL43719 | HEPTYLFORMAMIDE | N-Heptyl-formamide)
Show SMILES CCCCCCCNC=O
Show InChI InChI=1S/C8H17NO/c1-2-3-4-5-6-7-9-8-10/h8H,2-7H2,1H3,(H,9,10)
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3.60E+3n/an/an/an/an/an/an/an/a



The University of Iowa

Curated by ChEMBL


Assay Description
Inhibition of human alcohol dehydrogenase alpha activity


J Med Chem 41: 1696-701 (1998)


Article DOI: 10.1021/jm9707380
BindingDB Entry DOI: 10.7270/Q2VM4BC5
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
All-trans-retinol dehydrogenase [NAD(+)] ADH4


(Homo sapiens (Human))
BDBM50064266
PNG
(CHEMBL43719 | HEPTYLFORMAMIDE | N-Heptyl-formamide)
Show SMILES CCCCCCCNC=O
Show InChI InChI=1S/C8H17NO/c1-2-3-4-5-6-7-9-8-10/h8H,2-7H2,1H3,(H,9,10)
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PubMed
1.10E+4n/an/an/an/an/an/an/an/a



The University of Iowa

Curated by ChEMBL


Assay Description
Inhibition of human alcohol dehydrogenase pi activity


J Med Chem 41: 1696-701 (1998)


Article DOI: 10.1021/jm9707380
BindingDB Entry DOI: 10.7270/Q2VM4BC5
More data for this
Ligand-Target Pair
Alcohol dehydrogenase 1C


(Homo sapiens (Human))
BDBM50064266
PNG
(CHEMBL43719 | HEPTYLFORMAMIDE | N-Heptyl-formamide)
Show SMILES CCCCCCCNC=O
Show InChI InChI=1S/C8H17NO/c1-2-3-4-5-6-7-9-8-10/h8H,2-7H2,1H3,(H,9,10)
PDB
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Article
PubMed
1.20E+4n/an/an/an/an/an/an/an/a



The University of Iowa

Curated by ChEMBL


Assay Description
Inhibition of human alcohol dehydrogenase gamma2 activity


J Med Chem 41: 1696-701 (1998)


Article DOI: 10.1021/jm9707380
BindingDB Entry DOI: 10.7270/Q2VM4BC5
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)