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SMILES: NS(=O)(=O)c1nnc(NC(=O)CCNC(=O)c2c(F)c(F)c(F)c(F)c2F)s1

InChI Key: InChIKey=DMTMOWZOMISPMW-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50094460   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50094460
PNG
(2,3,4,5,6-Pentafluoro-N-[2-(5-sulfamoyl-[1,3,4]thi...)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCNC(=O)c2c(F)c(F)c(F)c(F)c2F)s1
Show InChI InChI=1S/C12H8F5N5O4S2/c13-5-4(6(14)8(16)9(17)7(5)15)10(24)19-2-1-3(23)20-11-21-22-12(27-11)28(18,25)26/h1-2H2,(H,19,24)(H2,18,25,26)(H,20,21,23)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
2n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase II (CA2)


J Med Chem 43: 4542-51 (2000)


BindingDB Entry DOI: 10.7270/Q2BV7HBP
More data for this
Ligand-Target Pair
Carbonic anhydrase 4


(Bos taurus (bovine))
BDBM50094460
PNG
(2,3,4,5,6-Pentafluoro-N-[2-(5-sulfamoyl-[1,3,4]thi...)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCNC(=O)c2c(F)c(F)c(F)c(F)c2F)s1
Show InChI InChI=1S/C12H8F5N5O4S2/c13-5-4(6(14)8(16)9(17)7(5)15)10(24)19-2-1-3(23)20-11-21-22-12(27-11)28(18,25)26/h1-2H2,(H,19,24)(H2,18,25,26)(H,20,21,23)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
10n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CA4) from bovine lung microsomes


J Med Chem 43: 4542-51 (2000)


BindingDB Entry DOI: 10.7270/Q2BV7HBP
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50094460
PNG
(2,3,4,5,6-Pentafluoro-N-[2-(5-sulfamoyl-[1,3,4]thi...)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCNC(=O)c2c(F)c(F)c(F)c(F)c2F)s1
Show InChI InChI=1S/C12H8F5N5O4S2/c13-5-4(6(14)8(16)9(17)7(5)15)10(24)19-2-1-3(23)20-11-21-22-12(27-11)28(18,25)26/h1-2H2,(H,19,24)(H2,18,25,26)(H,20,21,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
300n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase I (CA1)


J Med Chem 43: 4542-51 (2000)


BindingDB Entry DOI: 10.7270/Q2BV7HBP
More data for this
Ligand-Target Pair