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5 similar compounds to monomer 50373814

Compile data set for download or QSAR
Wt: 417.5
BDBM50373820
Wt: 459.5
BDBM50373822
Wt: 459.5
BDBM50373823
Wt: 431.4
BDBM50373824
Wt: 445.4
BDBM50373825

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50373820,50373822,50373823,50373824,50373825   
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
Lysophosphatidic acid receptor Edg-4


(Homo sapiens (Human))
BDBM50373820
PNG
(CHEMBL270878)
Show SMILES COc1ccccc1N1CCN(C[C@H](C)Nc2nc(nc3ccccc23)C2CC2)CC1
Show InChI InChI=1S/C25H31N5O/c1-18(17-29-13-15-30(16-14-29)22-9-5-6-10-23(22)31-2)26-25-20-7-3-4-8-21(20)27-24(28-25)19-11-12-19/h3-10,18-19H,11-17H2,1-2H3,(H,26,27,28)/t18-/m0/s1
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n/an/a 3.20E+3n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assay


Bioorg Med Chem Lett 18: 1037-41 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.024
BindingDB Entry DOI: 10.7270/Q2JQ11W8
More data for this
Ligand-Target Pair
Lysophosphatidic acid receptor Edg-4


(Homo sapiens (Human))
BDBM50373822
PNG
(CHEMBL257899)
Show SMILES COc1ccccc1N1CCN(CC(C)(C)Nc2nc(nc3ccccc23)C(F)(F)F)CC1
Show InChI InChI=1S/C24H28F3N5O/c1-23(2,16-31-12-14-32(15-13-31)19-10-6-7-11-20(19)33-3)30-21-17-8-4-5-9-18(17)28-22(29-21)24(25,26)27/h4-11H,12-16H2,1-3H3,(H,28,29,30)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assay


Bioorg Med Chem Lett 18: 1037-41 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.024
BindingDB Entry DOI: 10.7270/Q2JQ11W8
More data for this
Ligand-Target Pair
Lysophosphatidic acid receptor Edg-4


(Homo sapiens (Human))
BDBM50373825
PNG
(CHEMBL256478)
Show SMILES COc1ccccc1N1CCN(C[C@@H](C)Nc2nc(nc3ccccc23)C(F)(F)F)CC1
Show InChI InChI=1S/C23H26F3N5O/c1-16(15-30-11-13-31(14-12-30)19-9-5-6-10-20(19)32-2)27-21-17-7-3-4-8-18(17)28-22(29-21)23(24,25)26/h3-10,16H,11-15H2,1-2H3,(H,27,28,29)/t16-/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assay


Bioorg Med Chem Lett 18: 1037-41 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.024
BindingDB Entry DOI: 10.7270/Q2JQ11W8
More data for this
Ligand-Target Pair
Lysophosphatidic acid receptor Edg-4


(Homo sapiens (Human))
BDBM50373824
PNG
(CHEMBL272352)
Show SMILES COc1ccccc1N1CCN(CCNc2nc(nc3ccccc23)C(F)(F)F)CC1
Show InChI InChI=1S/C22H24F3N5O/c1-31-19-9-5-4-8-18(19)30-14-12-29(13-15-30)11-10-26-20-16-6-2-3-7-17(16)27-21(28-20)22(23,24)25/h2-9H,10-15H2,1H3,(H,26,27,28)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assay


Bioorg Med Chem Lett 18: 1037-41 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.024
BindingDB Entry DOI: 10.7270/Q2JQ11W8
More data for this
Ligand-Target Pair
Lysophosphatidic acid receptor Edg-4


(Homo sapiens (Human))
BDBM50373823
PNG
(CHEMBL406676)
Show SMILES CC[C@@H](CN1CCN(CC1)c1ccccc1OC)Nc1nc(nc2ccccc12)C(F)(F)F
Show InChI InChI=1S/C24H28F3N5O/c1-3-17(16-31-12-14-32(15-13-31)20-10-6-7-11-21(20)33-2)28-22-18-8-4-5-9-19(18)29-23(30-22)24(25,26)27/h4-11,17H,3,12-16H2,1-2H3,(H,28,29,30)/t17-/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assay


Bioorg Med Chem Lett 18: 1037-41 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.024
BindingDB Entry DOI: 10.7270/Q2JQ11W8
More data for this
Ligand-Target Pair