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BDBM50006458 CHEMBL68705::[5-Chloro-1-(5-trifluoromethyl-benzothiazol-2-ylmethyl)-1H-indazol-3-yl]-acetic acid

SMILES: OC(=O)Cc1nn(Cc2nc3cc(ccc3s2)C(F)(F)F)c2ccc(Cl)cc12

InChI Key: InChIKey=HTKRUXWKMYQBSI-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50006458   
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 (AR)


(Homo sapiens (Human))
BDBM50006458
PNG
(CHEMBL68705 | [5-Chloro-1-(5-trifluoromethyl-benzo...)
Show SMILES OC(=O)Cc1nn(Cc2nc3cc(ccc3s2)C(F)(F)F)c2ccc(Cl)cc12
Show InChI InChI=1S/C18H11ClF3N3O2S/c19-10-2-3-14-11(6-10)12(7-17(26)27)24-25(14)8-16-23-13-5-9(18(20,21)22)1-4-15(13)28-16/h1-6H,7-8H2,(H,26,27)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 35n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against aldose reductase isolated from human placenta


J Med Chem 35: 2155-62 (1992)


Article DOI: 10.1021/jm00090a002
BindingDB Entry DOI: 10.7270/Q2KK99RR
More data for this
Ligand-Target Pair