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BDBM50064280 CHEMBL295789::N-Cyclopentyl-formamide

SMILES: O=CNC1CCCC1

InChI Key: InChIKey=WYLHQTSQMKMTGM-UHFFFAOYSA-N

Data: 5 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50064280   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alcohol dehydrogenase


(Homo sapiens (Human))
BDBM50064280
PNG
(CHEMBL295789 | N-Cyclopentyl-formamide)
Show SMILES O=CNC1CCCC1
Show InChI InChI=1S/C6H11NO/c8-5-7-6-3-1-2-4-6/h5-6H,1-4H2,(H,7,8)
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Article
PubMed
3.90E+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
Alcohol dehydrogenase


(Homo sapiens (Human))
BDBM50064280
PNG
(CHEMBL295789 | N-Cyclopentyl-formamide)
Show SMILES O=CNC1CCCC1
Show InChI InChI=1S/C6H11NO/c8-5-7-6-3-1-2-4-6/h5-6H,1-4H2,(H,7,8)
PDB
MMDB

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UniProtKB/TrEMBL

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PC cid
PC sid
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Article
PubMed
7.30E+3n/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
Alcohol dehydrogenase


(Homo sapiens (Human))
BDBM50064280
PNG
(CHEMBL295789 | N-Cyclopentyl-formamide)
Show SMILES O=CNC1CCCC1
Show InChI InChI=1S/C6H11NO/c8-5-7-6-3-1-2-4-6/h5-6H,1-4H2,(H,7,8)
PDB
MMDB

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Article
PubMed
1.30E+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
Alcohol dehydrogenase


(Homo sapiens (Human))
BDBM50064280
PNG
(CHEMBL295789 | N-Cyclopentyl-formamide)
Show SMILES O=CNC1CCCC1
Show InChI InChI=1S/C6H11NO/c8-5-7-6-3-1-2-4-6/h5-6H,1-4H2,(H,7,8)
PDB
MMDB

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Article
PubMed
2.80E+4n/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


(Homo sapiens (Human))
BDBM50064280
PNG
(CHEMBL295789 | N-Cyclopentyl-formamide)
Show SMILES O=CNC1CCCC1
Show InChI InChI=1S/C6H11NO/c8-5-7-6-3-1-2-4-6/h5-6H,1-4H2,(H,7,8)
PDB
MMDB

Reactome pathway
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PC sid
UniChem

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Article
PubMed
1.50E+5n/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