BDBM50468028 CHEMBL4290236

SMILES Cc1coc2c1c(=O)oc(=O)c1c3CCCC(C)(C)c3ccc21

InChI Key InChIKey=AZZOSPOHDDQAFO-UHFFFAOYSA-N

Data  1 KI  4 IC50

  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 5 hits for monomerid = 50468028   

TargetLiver carboxylesterase 1(Homo sapiens (Human))
St. Jude Children'S Research Hospital

Curated by ChEMBL
LigandPNGBDBM50468028(CHEMBL4290236)
Affinity DataKi:  0.328nMAssay Description:Inhibition of human CE1 using o-NPA as substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCholinesterase(Homo sapiens (Human))
St. Jude Children'S Research Hospital

Curated by ChEMBL
LigandPNGBDBM50468028(CHEMBL4290236)
Affinity DataIC50:  7.88E+3nMAssay Description:Inhibition of human BuChE using butyrylhiocholine as substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetTryptophan 2,3-dioxygenase(Homo sapiens (Human))
Kunming Institute Of Botany

Curated by ChEMBL
LigandPNGBDBM50468028(CHEMBL4290236)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of recombinant human TDO assessed as reduction in N-formylkynurenine formation using L-tryptophan as substrate and measured after 15 minsMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetIndoleamine 2,3-dioxygenase 1(Homo sapiens (Human))
Kunming Institute Of Botany

Curated by ChEMBL
LigandPNGBDBM50468028(CHEMBL4290236)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of recombinant human IDO1 assessed as reduction in N-formylkynurenine formation using L-tryptophan as substrate and measured after 15 minsMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
St. Jude Children'S Research Hospital

Curated by ChEMBL
LigandPNGBDBM50468028(CHEMBL4290236)
Affinity DataIC50:  3.31E+3nMAssay Description:Inhibition of human AChE using acetylthiocholine as substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed