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 9 hits for monomerid = 12342   

TargetCarbonic anhydrase 9(Homo sapiens (Human))
Università degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi: >100nMAssay Description:Inhibition of human recombinant CA9 catalytic domain by stopped-flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2416X9PPubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Università 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 9(Homo sapiens (Human))
Università degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of human carbonic anhydrase 9 catalytic domain by Stopped-Flow CO2 Hydrase assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2P2710KPubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Università degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of human CA9 pre-incubated for 15 mins to 24 hrs measured after 6 hrs by phenol red-based stopped-flow CO2 hydrase assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q22Z15ZWPubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Università degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of human recombinant transmembrane CA9 catalytic domain after 6 hrs by stopped-flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XK8GVWPubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Università degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi: >2.00E+5nMAssay Description:Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2P26ZK0PubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Università degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi: >2.00E+5nMAssay Description:Inhibition of human recombinant carbonic anhydrase 9 preincubated for 15 mins to 72 hrs measured after 6 hrs by stopped flow CO2 hydration methodMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2FJ2H78PubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Università 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 recombinant CA9 after 6 hrs by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2KP82MQPubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Università degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM12342(2H-chromen-2-one | CHEMBL6466 | Coumarin)copy SMILEScopy InChI
Affinity DataKi: >1.00E+6nMAssay Description:Inhibition of human carbonic anhydrase 9 preincubated for 6 hrs by CO2 hydration stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2S75HNSPubMed