null

SMILES Nc1c(F)cc(cc1I)S(N)(=O)=O

InChI Key InChIKey=KDXNVSMWRXCNMY-UHFFFAOYSA-N

  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 8 hits for monomerid = 11607   

TargetCarbonic anhydrase 2(Homo sapiens (Human))
University of Agricultural Sciences and Veterinary Medicine

LigandPNGBDBM11607(β-CA inhibitor, 6 | 4-Amino-3-fluoro-5-iodobe...)copy SMILEScopy InChI
Affinity DataKi:  29nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XK8CR9PubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
University of Agricultural Sciences and Veterinary Medicine

LigandPNGBDBM11607(β-CA inhibitor, 6 | 4-Amino-3-fluoro-5-iodobe...)copy SMILEScopy InChI
Affinity DataKi:  34nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XK8CR9PubMed
TargetCarbonic anhydrase 4(Bos taurus (bovine))
University of Agricultural Sciences and Veterinary Medicine

LigandPNGBDBM11607(β-CA inhibitor, 6 | 4-Amino-3-fluoro-5-iodobe...)copy SMILEScopy InChI
Affinity DataKi:  125nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XK8CR9PubMed
TargetBeta-carbonic anhydrase 1(Mycobacterium tuberculosis)
Università degli Studi di Firenze

LigandPNGBDBM11607(β-CA inhibitor, 6 | 4-Amino-3-fluoro-5-iodobe...)copy SMILEScopy InChI
Affinity DataKi:  1.22E+3nM ΔG°:  -8.06kcal/molepH: 8.3 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity [Khalifah et al., J. Biol. Chem., ...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28C9V4FPubMed
TargetSiderophore-binding protein(Mycobacterium tuberculosis)
Università degli Studi di Firenze

LigandPNGBDBM11607(β-CA inhibitor, 6 | 4-Amino-3-fluoro-5-iodobe...)copy SMILEScopy InChI
Affinity DataKi:  2.79E+3nM ΔG°:  -7.57kcal/molepH: 8.3 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity [Khalifah et al., J. Biol. Chem., ...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28C9V4FPubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
University of Agricultural Sciences and Veterinary Medicine

LigandPNGBDBM11607(β-CA inhibitor, 6 | 4-Amino-3-fluoro-5-iodobe...)copy SMILEScopy InChI
Affinity DataKi:  3.70E+3nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XK8CR9PubMed
TargetCarbonic anhydrase 2(Mycobacterium tuberculosis)
Università degli Studi di Firenze

LigandPNGBDBM11607(β-CA inhibitor, 6 | 4-Amino-3-fluoro-5-iodobe...)copy SMILEScopy InChI
Affinity DataKi:  4.49E+3nM ΔG°:  -7.29kcal/molepH: 8.3 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity [Khalifah et al., J. Biol. Chem., ...More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q28C9V4FPubMed
TargetCarbonic anhydrase 3(Homo sapiens (Human))
Kochi Medical School

Curated by ChEMBL
LigandPNGBDBM11607(β-CA inhibitor, 6 | 4-Amino-3-fluoro-5-iodobe...)copy SMILEScopy InChI
Affinity DataKi:  1.90E+4nMAssay Description:Inhibition of human recombinant CA 3 assessed as CO2 hydration by stopped flow kinetic assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2TH8NJ9PubMed