null

SMILES O=c1ccc2ccccc2o1

InChI Key InChIKey=ZYGHJZDHTFUPRJ-UHFFFAOYSA-N

PDB links: 11 PDB IDs match this monomer. 30 PDB IDs contain this monomer as substructures. 30 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

  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 13 hits for monomerid = 12342   

TargetCarbonic anhydrase 14(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  48nMAssay Description:Inhibition of human carbonic anhydrase 14 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 6(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  2.00E+3nMAssay Description:Inhibition of human carbonic anhydrase 6 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  3.10E+3nMAssay Description:Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 7(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  3.30E+3nMAssay Description:Inhibition of human carbonic anhydrase 7 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 5B, mitochondrial(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  5.20E+3nMAssay Description:Inhibition of human carbonic anhydrase 5B by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 3(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  5.60E+3nMAssay Description:Inhibition of human carbonic anhydrase 3 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 4(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  6.80E+3nMAssay Description:Inhibition of human carbonic anhydrase 4 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 12(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  8.90E+3nMAssay Description:Inhibition of human carbonic anhydrase 12 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  9.10E+3nMAssay Description:Inhibition of human carbonic anhydrase 9 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 13(Mus musculus (mouse))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  9.20E+3nMAssay Description:Inhibition of mouse carbonic anhydrase 13 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 5A, mitochondrial(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  9.40E+3nMAssay Description:Inhibition of human carbonic anhydrase 5A by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 15(Mus musculus)
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi:  3.96E+4nMAssay Description:Inhibition of mouse carbonic anhydrase 15 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universita degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi: >5.00E+5nMAssay Description:Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2MS3TP5PubMed