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BDBM50405880 CHEMBL313338

SMILES: NS(=O)(=O)c1cc2ccccc2s1

InChI Key: InChIKey=UZMQSZBTFGHLAH-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 1 PDB ID matches this monomer.

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 1 hit for monomerid = 50405880   
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))
BDBM50405880
PNG
(CHEMBL313338)
Show SMILES NS(=O)(=O)c1cc2ccccc2s1
Show InChI InChI=1S/C8H7NO2S2/c9-13(10,11)8-5-6-3-1-2-4-7(6)12-8/h1-5H,(H2,9,10,11)
PDB
MMDB

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PC cid
PC sid
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Similars

PubMed
n/an/a 5.20n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
50% inhibition of human carbonic anhydrase II assayed by CO2 hydration catalyzed by human erythrocytes


J Med Chem 32: 2548-54 (1989)


BindingDB Entry DOI: 10.7270/Q23X87TJ
More data for this
Ligand-Target Pair