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SMILES: Clc1ccccc1[C@@H](NS(=O)(=O)c1ccc2OCCOc2c1)c1cc2ccccc2s1

InChI Key: InChIKey=LBZRWOSPKDKIOG-HSZRJFAPSA-N

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 2 hits for monomerid = 50500215   
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
Glucokinase regulatory protein


(Mus musculus)
BDBM50500215
PNG
(CHEMBL3746762)
Show SMILES Clc1ccccc1[C@@H](NS(=O)(=O)c1ccc2OCCOc2c1)c1cc2ccccc2s1 |r|
Show InChI InChI=1S/C23H18ClNO4S2/c24-18-7-3-2-6-17(18)23(22-13-15-5-1-4-8-21(15)30-22)25-31(26,27)16-9-10-19-20(14-16)29-12-11-28-19/h1-10,13-14,23,25H,11-12H2/t23-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.25E+4n/an/an/an/a



Amgen

Curated by ChEMBL


Assay Description
Inhibition of glucokinase-GKRP binding interaction in mouse hepatocytes assessed as induction of glucokinase translocation


J Med Chem 58: 9663-79 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01367
BindingDB Entry DOI: 10.7270/Q27M0BZP
More data for this
Ligand-Target Pair
Glucokinase regulatory protein


(Homo sapiens (Human))
BDBM50500215
PNG
(CHEMBL3746762)
Show SMILES Clc1ccccc1[C@@H](NS(=O)(=O)c1ccc2OCCOc2c1)c1cc2ccccc2s1 |r|
Show InChI InChI=1S/C23H18ClNO4S2/c24-18-7-3-2-6-17(18)23(22-13-15-5-1-4-8-21(15)30-22)25-31(26,27)16-9-10-19-20(14-16)29-12-11-28-19/h1-10,13-14,23,25H,11-12H2/t23-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.50E+3n/an/an/an/an/an/a



Amgen

Curated by ChEMBL


Assay Description
Binding affinity to human biotinylated AviTag GKRP assessed as inhibition of protein interaction with fluorescein tagged human glucokinase by AlphaSc...


J Med Chem 58: 9663-79 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01367
BindingDB Entry DOI: 10.7270/Q27M0BZP
More data for this
Ligand-Target Pair