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BDBM50186221 CHEMBL3822759

SMILES: CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2cc(ncc12)-c1ccc(cc1)S(C)(=O)=O

InChI Key: InChIKey=PJOSUSMXOUOJNU-UHFFFAOYSA-N

Data: 2 EC50

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 = 50186221   
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
Glucose-dependent insulinotropic receptor


(Homo sapiens (Human))
BDBM50186221
PNG
(CHEMBL3822759)
Show SMILES CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2cc(ncc12)-c1ccc(cc1)S(C)(=O)=O
Show InChI InChI=1S/C23H28N4O4S/c1-23(2,3)31-22(28)26-11-9-18(10-12-26)27-21-15-24-20(13-17(21)14-25-27)16-5-7-19(8-6-16)32(4,29)30/h5-8,13-15,18H,9-12H2,1-4H3
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 20n/an/an/an/a



Taisho Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 expressed in Flp-In-T-Rex-HEK293 cells assessed as stimulation of cAMP level measured after 30 mins by HTRF assay


Bioorg Med Chem 25: 4339-4354 (2017)


Article DOI: 10.1016/j.bmc.2017.06.014
BindingDB Entry DOI: 10.7270/Q21V5HFG
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50186221
PNG
(CHEMBL3822759)
Show SMILES CC(C)(C)OC(=O)N1CCC(CC1)n1ncc2cc(ncc12)-c1ccc(cc1)S(C)(=O)=O
Show InChI InChI=1S/C23H28N4O4S/c1-23(2,3)31-22(28)26-11-9-18(10-12-26)27-21-15-24-20(13-17(21)14-25-27)16-5-7-19(8-6-16)32(4,29)30/h5-8,13-15,18H,9-12H2,1-4H3
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/an/an/a 20n/an/an/an/a



Taisho Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 expressed in Flp-In-T-Rex-HEK293 cells after 30 mins by cAMP accumulation assay


Bioorg Med Chem Lett 26: 3441-6 (2016)


BindingDB Entry DOI: 10.7270/Q2XW4MRS
More data for this
Ligand-Target Pair