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Compile Data Set for Download or QSAR

Found 3 hits of ec50 for monomerid = 50207069   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Free fatty acid receptor 4


(Homo sapiens (Human))
BDBM50207069
PNG
(CHEMBL3959068)
Show SMILES [H][C@]1(C[C@@]1([H])[C@@]1([H])CCc2cc(ccc2O1)-c1cc(O[C@H]2C[C@@H](C2)OC)cc(F)c1F)C(O)=O |r,wU:5.6,1.0,20.22,wD:3.4,22.27,(25.35,-14.1,;25.76,-15.6,;25.75,-17.14,;24.43,-16.36,;24.41,-17.9,;23.08,-15.59,;22.96,-17.12,;23.09,-14.03,;21.74,-13.25,;20.4,-14.03,;19.07,-13.27,;17.74,-14.04,;17.73,-15.59,;19.06,-16.36,;20.39,-15.59,;21.74,-16.36,;16.4,-13.27,;15.07,-14.04,;13.74,-13.27,;12.4,-14.05,;11.07,-13.29,;9.59,-13.69,;9.19,-12.21,;10.67,-11.8,;7.86,-11.45,;7.86,-9.92,;13.73,-11.73,;15.07,-10.95,;15.07,-9.43,;16.41,-11.72,;17.74,-10.95,;27.1,-16.37,;27.09,-17.91,;28.43,-15.6,)|
Show InChI InChI=1S/C24H24F2O5/c1-29-14-7-15(8-14)30-16-9-17(23(26)20(25)10-16)12-2-4-21-13(6-12)3-5-22(31-21)18-11-19(18)24(27)28/h2,4,6,9-10,14-15,18-19,22H,3,5,7-8,11H2,1H3,(H,27,28)/t14-,15-,18-,19-,22-/m1/s1
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PubMed
n/an/an/an/a 17n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Agonist activity at human GPR120 short isoform expressed in CHOK1 cells assessed as beta-arrestin recruitment after 90 mins by luminescence assay


ACS Med Chem Lett 8: 96-101 (2017)


Article DOI: 10.1021/acsmedchemlett.6b00394
BindingDB Entry DOI: 10.7270/Q2R213CP
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens (Human))
BDBM50207069
PNG
(CHEMBL3959068)
Show SMILES [H][C@]1(C[C@@]1([H])[C@@]1([H])CCc2cc(ccc2O1)-c1cc(O[C@H]2C[C@@H](C2)OC)cc(F)c1F)C(O)=O |r,wU:5.6,1.0,20.22,wD:3.4,22.27,(25.35,-14.1,;25.76,-15.6,;25.75,-17.14,;24.43,-16.36,;24.41,-17.9,;23.08,-15.59,;22.96,-17.12,;23.09,-14.03,;21.74,-13.25,;20.4,-14.03,;19.07,-13.27,;17.74,-14.04,;17.73,-15.59,;19.06,-16.36,;20.39,-15.59,;21.74,-16.36,;16.4,-13.27,;15.07,-14.04,;13.74,-13.27,;12.4,-14.05,;11.07,-13.29,;9.59,-13.69,;9.19,-12.21,;10.67,-11.8,;7.86,-11.45,;7.86,-9.92,;13.73,-11.73,;15.07,-10.95,;15.07,-9.43,;16.41,-11.72,;17.74,-10.95,;27.1,-16.37,;27.09,-17.91,;28.43,-15.6,)|
Show InChI InChI=1S/C24H24F2O5/c1-29-14-7-15(8-14)30-16-9-17(23(26)20(25)10-16)12-2-4-21-13(6-12)3-5-22(31-21)18-11-19(18)24(27)28/h2,4,6,9-10,14-15,18-19,22H,3,5,7-8,11H2,1H3,(H,27,28)/t14-,15-,18-,19-,22-/m1/s1
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n/an/an/an/a 45n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Agonist activity at human GPR120 short isoform expressed in CHOK1 cells assessed as increase in IP1 accumulation after 60 mins by HTRF assay


ACS Med Chem Lett 8: 96-101 (2017)


Article DOI: 10.1021/acsmedchemlett.6b00394
BindingDB Entry DOI: 10.7270/Q2R213CP
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50207069
PNG
(CHEMBL3959068)
Show SMILES [H][C@]1(C[C@@]1([H])[C@@]1([H])CCc2cc(ccc2O1)-c1cc(O[C@H]2C[C@@H](C2)OC)cc(F)c1F)C(O)=O |r,wU:5.6,1.0,20.22,wD:3.4,22.27,(25.35,-14.1,;25.76,-15.6,;25.75,-17.14,;24.43,-16.36,;24.41,-17.9,;23.08,-15.59,;22.96,-17.12,;23.09,-14.03,;21.74,-13.25,;20.4,-14.03,;19.07,-13.27,;17.74,-14.04,;17.73,-15.59,;19.06,-16.36,;20.39,-15.59,;21.74,-16.36,;16.4,-13.27,;15.07,-14.04,;13.74,-13.27,;12.4,-14.05,;11.07,-13.29,;9.59,-13.69,;9.19,-12.21,;10.67,-11.8,;7.86,-11.45,;7.86,-9.92,;13.73,-11.73,;15.07,-10.95,;15.07,-9.43,;16.41,-11.72,;17.74,-10.95,;27.1,-16.37,;27.09,-17.91,;28.43,-15.6,)|
Show InChI InChI=1S/C24H24F2O5/c1-29-14-7-15(8-14)30-16-9-17(23(26)20(25)10-16)12-2-4-21-13(6-12)3-5-22(31-21)18-11-19(18)24(27)28/h2,4,6,9-10,14-15,18-19,22H,3,5,7-8,11H2,1H3,(H,27,28)/t14-,15-,18-,19-,22-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
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Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in HEK293 cells assessed as increase in IP1 accumulation after 60 mins by HTRF assay


ACS Med Chem Lett 8: 96-101 (2017)


Article DOI: 10.1021/acsmedchemlett.6b00394
BindingDB Entry DOI: 10.7270/Q2R213CP
More data for this
Ligand-Target Pair