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BDBM50222612 2-(2,6-dimethyl-4-(2-o-tolylacetamido)phenylsulfonamido)acetic acid::CHEMBL240719::[2,6-DIMETHYL-4-(2-O-TOLYL-ACETYLAMINO)-BENZENESULFONYL]-GLYCINE

SMILES: Cc1ccccc1CC(=O)Nc1cc(C)c(c(C)c1)S(=O)(=O)NCC(O)=O

InChI Key: InChIKey=CJKKMQCZOLCXAM-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 2 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 = 50222612   
Target
(Institution)
LigandTarget
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
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM50222612
PNG
(2-(2,6-dimethyl-4-(2-o-tolylacetamido)phenylsulfon...)
Show SMILES Cc1ccccc1CC(=O)Nc1cc(C)c(c(C)c1)S(=O)(=O)NCC(O)=O
Show InChI InChI=1S/C19H22N2O5S/c1-12-6-4-5-7-15(12)10-17(22)21-16-8-13(2)19(14(3)9-16)27(25,26)20-11-18(23)24/h4-9,20H,10-11H2,1-3H3,(H,21,22)(H,23,24)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Similars

AffyNet 
PDB
Article
PubMed
n/an/a 108n/an/an/an/an/an/a



Università di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Inhibition of aldose reductase


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)