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BDBM50087248 3-Chloro-4-[(7-chloro-2-oxo-2H-chromen-4-ylmethyl)-amino]-benzenesulfonamide::CHEMBL158827

SMILES: NS(=O)(=O)c1ccc(NCc2cc(=O)oc3cc(Cl)ccc23)c(Cl)c1

InChI Key: InChIKey=ANVRZEGNTAGLOH-UHFFFAOYSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50087248   
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))
BDBM50087248
PNG
(3-Chloro-4-[(7-chloro-2-oxo-2H-chromen-4-ylmethyl)...)
Show SMILES NS(=O)(=O)c1ccc(NCc2cc(=O)oc3cc(Cl)ccc23)c(Cl)c1
Show InChI InChI=1S/C16H12Cl2N2O4S/c17-10-1-3-12-9(5-16(21)24-15(12)6-10)8-20-14-4-2-11(7-13(14)18)25(19,22)23/h1-7,20H,8H2,(H2,19,22,23)
PDB
MMDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
45n/an/an/an/an/an/an/an/a



Universit£ degli Studi

Curated by ChEMBL


Assay Description
Inhibition of human cloned Carbonic anhydrase II


Bioorg Med Chem Lett 10: 673-6 (2000)


BindingDB Entry DOI: 10.7270/Q2RV0P61
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM50087248
PNG
(3-Chloro-4-[(7-chloro-2-oxo-2H-chromen-4-ylmethyl)...)
Show SMILES NS(=O)(=O)c1ccc(NCc2cc(=O)oc3cc(Cl)ccc23)c(Cl)c1
Show InChI InChI=1S/C16H12Cl2N2O4S/c17-10-1-3-12-9(5-16(21)24-15(12)6-10)8-20-14-4-2-11(7-13(14)18)25(19,22)23/h1-7,20H,8H2,(H2,19,22,23)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
96n/an/an/an/an/an/an/an/a



Universit£ degli Studi

Curated by ChEMBL


Assay Description
Inhibition of bovine Carbonic anhydrase IV determined by esterase method


Bioorg Med Chem Lett 10: 673-6 (2000)


BindingDB Entry DOI: 10.7270/Q2RV0P61
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50087248
PNG
(3-Chloro-4-[(7-chloro-2-oxo-2H-chromen-4-ylmethyl)...)
Show SMILES NS(=O)(=O)c1ccc(NCc2cc(=O)oc3cc(Cl)ccc23)c(Cl)c1
Show InChI InChI=1S/C16H12Cl2N2O4S/c17-10-1-3-12-9(5-16(21)24-15(12)6-10)8-20-14-4-2-11(7-13(14)18)25(19,22)23/h1-7,20H,8H2,(H2,19,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
520n/an/an/an/an/an/an/an/a



Universit£ degli Studi

Curated by ChEMBL


Assay Description
Inhibition of human cloned Carbonic anhydrase I


Bioorg Med Chem Lett 10: 673-6 (2000)


BindingDB Entry DOI: 10.7270/Q2RV0P61
More data for this
Ligand-Target Pair