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BDBM50106211 CHEMBL3598104

SMILES: CCC(F)(F)C(=O)N1CCC(CC1)O[C@H]1CC[C@@H](CC1)Oc1cnc(cn1)S(C)(=O)=O

InChI Key: InChIKey=RRZKJFUOXRQZDN-SHTZXODSSA-N

Data: 3 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 3 hits for monomerid = 50106211   
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
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50106211
PNG
(CHEMBL3598104)
Show SMILES CCC(F)(F)C(=O)N1CCC(CC1)O[C@H]1CC[C@@H](CC1)Oc1cnc(cn1)S(C)(=O)=O |r,wU:17.21,wD:14.14,(-.23,10.62,;-1.3,10.01,;-1.31,8.47,;-.24,9.08,;-.24,7.85,;-2.65,7.7,;-3.71,8.33,;-2.65,6.16,;-3.99,5.4,;-4,3.86,;-2.66,3.08,;-1.33,3.85,;-1.32,5.39,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;2.67,-1.54,;4,-.77,;4,.77,;5.33,1.55,;6.67,.78,;6.67,-.76,;5.34,-1.53,;8,1.56,;9.06,2.18,;9.07,.95,;7.99,2.79,)|
Show InChI InChI=1S/C20H29F2N3O5S/c1-3-20(21,22)19(26)25-10-8-16(9-11-25)29-14-4-6-15(7-5-14)30-17-12-24-18(13-23-17)31(2,27)28/h12-16H,3-11H2,1-2H3/t14-,15-
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 5.30n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 by HTRF cAMP assay


Bioorg Med Chem Lett 25: 3034-8 (2015)


BindingDB Entry DOI: 10.7270/Q2SB47JS
More data for this
Ligand-Target Pair
Glucose-dependent insulinotropic receptor


(Rattus norvegicus)
BDBM50106211
PNG
(CHEMBL3598104)
Show SMILES CCC(F)(F)C(=O)N1CCC(CC1)O[C@H]1CC[C@@H](CC1)Oc1cnc(cn1)S(C)(=O)=O |r,wU:17.21,wD:14.14,(-.23,10.62,;-1.3,10.01,;-1.31,8.47,;-.24,9.08,;-.24,7.85,;-2.65,7.7,;-3.71,8.33,;-2.65,6.16,;-3.99,5.4,;-4,3.86,;-2.66,3.08,;-1.33,3.85,;-1.32,5.39,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;2.67,-1.54,;4,-.77,;4,.77,;5.33,1.55,;6.67,.78,;6.67,-.76,;5.34,-1.53,;8,1.56,;9.06,2.18,;9.07,.95,;7.99,2.79,)|
Show InChI InChI=1S/C20H29F2N3O5S/c1-3-20(21,22)19(26)25-10-8-16(9-11-25)29-14-4-6-15(7-5-14)30-17-12-24-18(13-23-17)31(2,27)28/h12-16H,3-11H2,1-2H3/t14-,15-
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 67n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR119 by HTRF cAMP assay


Bioorg Med Chem Lett 25: 3034-8 (2015)


BindingDB Entry DOI: 10.7270/Q2SB47JS
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50106211
PNG
(CHEMBL3598104)
Show SMILES CCC(F)(F)C(=O)N1CCC(CC1)O[C@H]1CC[C@@H](CC1)Oc1cnc(cn1)S(C)(=O)=O |r,wU:17.21,wD:14.14,(-.23,10.62,;-1.3,10.01,;-1.31,8.47,;-.24,9.08,;-.24,7.85,;-2.65,7.7,;-3.71,8.33,;-2.65,6.16,;-3.99,5.4,;-4,3.86,;-2.66,3.08,;-1.33,3.85,;-1.32,5.39,;-2.67,1.54,;-1.33,.77,;-1.33,-.77,;,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;2.67,-1.54,;4,-.77,;4,.77,;5.33,1.55,;6.67,.78,;6.67,-.76,;5.34,-1.53,;8,1.56,;9.06,2.18,;9.07,.95,;7.99,2.79,)|
Show InChI InChI=1S/C20H29F2N3O5S/c1-3-20(21,22)19(26)25-10-8-16(9-11-25)29-14-4-6-15(7-5-14)30-17-12-24-18(13-23-17)31(2,27)28/h12-16H,3-11H2,1-2H3/t14-,15-
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 29n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 by serum shift assay


Bioorg Med Chem Lett 25: 3034-8 (2015)


BindingDB Entry DOI: 10.7270/Q2SB47JS
More data for this
Ligand-Target Pair