BDBM50174558 7-hydroxy-2H-1-benzopyran-2-one::7-hydroxy-2H-chromen-2-one::CHEMBL51628::Coumarin derivative, 3a::beta-umbelliferone::hydrangin::skimmetin::umbelliferone

SMILES c1cc2c(cc1O)OC(=O)C=C2

InChI Key InChIKey=ORHBXUUXSCNDEV-UHFFFAOYSA-N

Data  17 KI  18 IC50

PDB links: 5 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 35 hits for monomerid = 50174558   

TargetBeta-secretase 1(Human)
Kinki University

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of recombinant human BACE1 using Rh-EVNLDAEFK as substrate after 60 mins by fluorescence quenching assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/22/2012
Entry Details Article
PubMed
TargetPolyphenol oxidase 2(White button mushroom)
Mazandaran University of Medical Sciences

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 4.20E+5nMAssay Description:Inhibition of mushroom tyrosinase assessed as reduction in dopachrome formation using L-DOPA as substrate preincubated with enzyme for 10 mins follow...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2022
Entry Details Article
PubMed
TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Human)
Dalian University of Technology

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 2.10E+4nMAssay Description:Displacement of FAM-Bid peptide from recombinant N-terminal His6x-tagged human Mcl-1 expressed in Escherichia coli BL21 (DE3) incubated for 30 mins b...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/25/2022
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
University of Monastir

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of acetylcholinesterase (unknown origin) using acetylcholine iodide as substrate preincubated for 15 mins prior to substrate addition by s...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetDihydroorotate dehydrogenase (fumarate)(Leishmania major)
University of S£O Paulo

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 4.67E+5nMAssay Description:Inhibition of recombinant oligo-histidine-tagged Leishmania major DHODH expressed in Escherichia coli BL21(DE3) cells using DHO as substrate measured...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetDihydroorotate dehydrogenase (fumarate)(Leishmania major)
University of S£O Paulo

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 5.01E+5nMAssay Description:Inhibition of recombinant oligo-histidine-tagged Leishmania major DHODH expressed in Escherichia coli BL21(DE3) cells using DHO as substrate measured...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2020
Entry Details Article
PubMed
TargetGlyceraldehyde-3-phosphate dehydrogenase(Human)
Universidade Federal De Minas Gerais

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 6.17E+5nMAssay Description:Inhibitory concentration against glyceraldehyde-3-phosphate dehydrogenase was determined as log 1/IC50More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetAcetylcholinesterase(Human)
University of Monastir

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 2.90E+7nMAssay Description:Inhibition of AChE by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2012
Entry Details Article
PubMed
TargetGlyceraldehyde-3-phosphate dehydrogenase, glycosomal(Trypanosoma cruzi)
Universidade De S£O Paulo

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 6.17E+5nMAssay Description:Inhibition of Trypanosoma cruzi recombinant glycosomal GAPDH expressed in Escherichia coli by spectrophotometryMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/20/2012
Entry Details Article
PubMed
TargetAcetylcholinesterase(Electric eel)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 1.40E+5nMAssay Description:Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 6 mins prior to substrate addition measured at 60 to 180...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetCholinesterase(Horse)
China Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of equine serum BChE using S-butyrylthiocholine iodide as substrate preincubated for 6 mins prior to substrate addition measured at 60 to ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
Target3-oxo-5-alpha-steroid 4-dehydrogenase 1(Human)
Seoul National University

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 1.23E+5nMAssay Description:Inhibitory activity against 5-alpha-reductase type 1 in cell culture system using LNCaP cells (androgen-sensitive human prostatic cancer cell line)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/4/2012
Entry Details Article
PubMed
TargetTyrosinase(Human)
Universidad De Santiago De Compostela

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 4.20E+5nMAssay Description:Inhibition of tyrosinaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2011
Entry Details Article
PubMed
TargetGenome polyprotein(HCV)
Umdnj-New Jersey Medical School

LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 3.66E+4nMpH: 7.0 T: 2°CAssay Description:Inhibition assay using HCV NS5B.More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2013
Entry Details Article
PubMed
TargetSeed linoleate 13S-lipoxygenase-1(Soybean)
Aristotle University of Thessaloniki

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 4.30E+4nMAssay Description:Inhibitory concentration against soybean lipoxygenase upon incubation with sodium linoleate (0.1 mM) at RTMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetXanthine dehydrogenase/oxidase(Human)
Università

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 2.36E+5nMAssay Description:Inhibition of xanthine oxidaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetSorbitol dehydrogenase(Human)
University of Toyama

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 1.20E+5nMAssay Description:Inhibition sorbitol dehydrogenase by spectrophotometric analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/12/2011
Entry Details Article
PubMed
TargetAldo-keto reductase family 1 member B1(Human)
University of Toyama

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataIC50: 2.29E+4nMAssay Description:Inhibition human recombinant aldose reductase 1 by spectrophotometric analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/12/2011
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  25nMAssay Description:Inhibition of human carbonic anhydrase 9 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  45nMAssay Description:Inhibition of human carbonic anhydrase 12 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  478nMAssay Description:Inhibition of human recombinant CA9 after 6 hrs by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/22/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  480nMAssay Description:Inhibition of human carbonic anhydrase 9 catalytic domain by Stopped-Flow CO2 Hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/10/2017
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  482nMAssay Description:Inhibition of human recombinant CA9 catalytic domain by stopped-flow CO2 hydration methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/14/2011
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  750nMAssay Description:Inhibition of human carbonic anhydrase 12 catalytic domain by Stopped-Flow CO2 Hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/10/2017
Entry Details Article
PubMed
TargetZn finger protein(Common tobacco)
Università

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  754nMAssay Description:Inhibition of human recombinant CA12 catalytic domain by stopped-flow CO2 hydration methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/14/2011
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  754nMAssay Description:Inhibition of human recombinant CA12 after 6 hrs by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/22/2012
Entry Details Article
PubMed
TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Human)
Dalian University of Technology

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  3.81E+3nMAssay Description:Displacement of FAM-Bid peptide from recombinant N-terminal His6x-tagged human Mcl-1 expressed in Escherichia coli BL21 (DE3) incubated for 30 mins b...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/25/2022
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of human carbonic anhydrase 2 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of human carbonic anhydrase 1 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  5.84E+4nMAssay Description:Inhibition of full length human CA1 cytosolic isoform by stopped-flow CO2 hydration methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/14/2011
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  5.84E+4nMAssay Description:Inhibition of human carbonic anhydrase 1 by Stopped-Flow CO2 Hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/10/2017
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi:  5.84E+4nMAssay Description:Inhibition of human full-length cytosolic CA1 after 6 hrs by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/22/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of human carbonic anhydrase 2 by Stopped-Flow CO2 Hydrase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/10/2017
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of human full-length cytosolic CA2 after 6 hrs by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/22/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM50174558(umbelliferone | CHEMBL51628 | skimmetin | Coumarin...)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of full length human CA2 cytosolic isoform by stopped-flow CO2 hydration methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/14/2011
Entry Details Article
PubMed