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BDBM50128215 CHEMBL71872::Sulfamic acid 4-methoxy-phenyl ester

SMILES: COc1ccc(OS(N)(=O)=O)cc1

InChI Key: InChIKey=XAQTXSHCLKDVCM-UHFFFAOYSA-N

Data: 3 KI

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 = 50128215   
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))
BDBM50128215
PNG
(CHEMBL71872 | Sulfamic acid 4-methoxy-phenyl ester)
Show SMILES COc1ccc(OS(N)(=O)=O)cc1
Show InChI InChI=1S/C7H9NO4S/c1-11-6-2-4-7(5-3-6)12-13(8,9)10/h2-5H,1H3,(H2,8,9,10)
PDB
MMDB

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Article
PubMed
1.60n/an/an/an/an/an/an/an/a



Universit£ Montpellier II

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II


J Med Chem 46: 2197-204 (2003)


Article DOI: 10.1021/jm021124k
BindingDB Entry DOI: 10.7270/Q28P617T
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50128215
PNG
(CHEMBL71872 | Sulfamic acid 4-methoxy-phenyl ester)
Show SMILES COc1ccc(OS(N)(=O)=O)cc1
Show InChI InChI=1S/C7H9NO4S/c1-11-6-2-4-7(5-3-6)12-13(8,9)10/h2-5H,1H3,(H2,8,9,10)
PDB
MMDB

NCI pathway
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UniProtKB/TrEMBL

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DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
33n/an/an/an/an/an/an/an/a



Universit£ Montpellier II

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase I


J Med Chem 46: 2197-204 (2003)


Article DOI: 10.1021/jm021124k
BindingDB Entry DOI: 10.7270/Q28P617T
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50128215
PNG
(CHEMBL71872 | Sulfamic acid 4-methoxy-phenyl ester)
Show SMILES COc1ccc(OS(N)(=O)=O)cc1
Show InChI InChI=1S/C7H9NO4S/c1-11-6-2-4-7(5-3-6)12-13(8,9)10/h2-5H,1H3,(H2,8,9,10)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
34n/an/an/an/an/an/an/an/a



Universit£ Montpellier II

Curated by ChEMBL


Assay Description
Inhibitory concentration against catalytic domain of human cloned carbonic anhydrase IX.


J Med Chem 46: 2197-204 (2003)


Article DOI: 10.1021/jm021124k
BindingDB Entry DOI: 10.7270/Q28P617T
More data for this
Ligand-Target Pair