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BDBM50099669 CHEMBL295139::Succinic acid benzyl ester 3-carboxymethyl-1-(4-chloro-benzoyl)-2-methyl-1H-indol-5-yl ester

SMILES: Cc1c(CC(O)=O)c2cc(OC(=O)CCC(=O)OCc3ccccc3)ccc2n1C(=O)c1ccc(Cl)cc1

InChI Key: InChIKey=QVDAJXFPQSTEKZ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50099669   
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
Aldose reductase (ALR2)


(Bos taurus (Cattle))
BDBM50099669
PNG
(CHEMBL295139 | Succinic acid benzyl ester 3-carbox...)
Show SMILES Cc1c(CC(O)=O)c2cc(OC(=O)CCC(=O)OCc3ccccc3)ccc2n1C(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C29H24ClNO7/c1-18-23(16-26(32)33)24-15-22(11-12-25(24)31(18)29(36)20-7-9-21(30)10-8-20)38-28(35)14-13-27(34)37-17-19-5-3-2-4-6-19/h2-12,15H,13-14,16-17H2,1H3,(H,32,33)
PDB

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PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 210n/an/an/an/an/an/a



Sankyo Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of Aldose reductase (AR)


J Med Chem 44: 1718-28 (2001)


BindingDB Entry DOI: 10.7270/Q2N0177X
More data for this
Ligand-Target Pair