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BDBM50043906 CHEMBL269001::Dorzolamide::MK-507

SMILES: CCNC1CC(C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O

InChI Key: InChIKey=IAVUPMFITXYVAF-UHFFFAOYSA-N

Data: 1 KI  1 IC50

PDB links: 5 PDB IDs match 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 = 50043906   
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
6-phosphogluconate dehydrogenase (6PGD)


(Homo sapiens (Human))
BDBM50043906
PNG
(CHEMBL269001 | Dorzolamide | MK-507)
Show SMILES CCNC1CC(C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O
Show InChI InChI=1S/C10H16N2O4S3/c1-3-12-8-4-6(2)18(13,14)10-7(8)5-9(17-10)19(11,15)16/h5-6,8,12H,3-4H2,1-2H3,(H2,11,15,16)
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MMDB

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Article
PubMed
3.14E+6n/a 1.41E+6n/an/an/an/an/an/a



Dumlupinar University



Assay Description
The enzyme activities in the absence of drugs or chemicals were taken as 100%. For each drug or chemical, an activity%-(drug) graph was drawn and dr...


J Enzyme Inhib Med Chem 23: 418-23 (2008)

More data for this
Ligand-Target Pair