Compile Data Set for Download or QSAR
Found 141 Enz. Inhib. hit(s) with Target = 'Lysophosphatidic acid receptor 2'
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50271765(3-(4-{3-[4-(3-Carboxy-acryloylamino)-phenoxy]-phen...)
Show SMILES OC(=O)\C=C\C(=O)Nc1ccc(Oc2cccc(Oc3ccc(NC(=O)\C=C\C(O)=O)cc3)c2)cc1
Show InChI InChI=1S/C26H20N2O8/c29-23(12-14-25(31)32)27-17-4-8-19(9-5-17)35-21-2-1-3-22(16-21)36-20-10-6-18(7-11-20)28-24(30)13-15-26(33)34/h1-16H,(H,27,29)(H,28,30)(H,31,32)(H,33,34)/b14-12+,15-13+
Affinity DataKi:  7.20nMAssay Description:Antagonist activity at LPA2 receptor (unknown origin) expressed in rat RH7777 cells assessed as inhibition of LPA-induced intracellular calcium conce...More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50271763(3-[3-(3-Carboxy-acryloylamino)-phenylcarbamoyl]-ac...)
Show SMILES OC(=O)\C=C\C(=O)Nc1cccc(NC(=O)\C=C\C(O)=O)c1
Show InChI InChI=1S/C14H12N2O6/c17-11(4-6-13(19)20)15-9-2-1-3-10(8-9)16-12(18)5-7-14(21)22/h1-8H,(H,15,17)(H,16,18)(H,19,20)(H,21,22)/b6-4+,7-5+
Affinity DataKi:  20.8nMAssay Description:Antagonist activity at LPA2 receptor (unknown origin) expressed in rat RH7777 cells assessed as inhibition of LPA-induced intracellular calcium conce...More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50271764(3-[4'-(3-Carboxy-acryloylamino)-biphenyl-4-ylcarba...)
Show SMILES OC(=O)\C=C\C(=O)Nc1ccc(cc1)-c1ccc(NC(=O)\C=C\C(O)=O)cc1
Show InChI InChI=1S/C20H16N2O6/c23-17(9-11-19(25)26)21-15-5-1-13(2-6-15)14-3-7-16(8-4-14)22-18(24)10-12-20(27)28/h1-12H,(H,21,23)(H,22,24)(H,25,26)(H,27,28)/b11-9+,12-10+
Affinity DataKi:  21.1nMAssay Description:Antagonist activity at LPA2 receptor (unknown origin) expressed in rat RH7777 cells assessed as inhibition of LPA-induced intracellular calcium conce...More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50177331(CHEMBL381470 | potassium (2-dodecyl-1,3-dioxolan-4...)
Show SMILES CCCCCCCCCCCCC1OCC(COP(O)([O-])=O)O1
Show InChI InChI=1S/C16H33O6P/c1-2-3-4-5-6-7-8-9-10-11-12-16-20-13-15(22-16)14-21-23(17,18)19/h15-16H,2-14H2,1H3,(H2,17,18,19)/p-1
Affinity DataKi:  745nMAssay Description:Activity at LPA2 receptor in RH7777 rat hepatoma cell lineMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50177331(CHEMBL381470 | potassium (2-dodecyl-1,3-dioxolan-4...)
Show SMILES CCCCCCCCCCCCC1OCC(COP(O)([O-])=O)O1
Show InChI InChI=1S/C16H33O6P/c1-2-3-4-5-6-7-8-9-10-11-12-16-20-13-15(22-16)14-21-23(17,18)19/h15-16H,2-14H2,1H3,(H2,17,18,19)/p-1
Affinity DataKi:  745nMAssay Description:Activity at LPA2 receptor in RH7777 rat hepatoma cell lineMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50170846(CHEMBL190999 | Tetradecyl-phosphonic acid)
Show SMILES CCCCCCCCCCCCCCP(O)(O)=O
Show InChI InChI=1S/C14H31O3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18(15,16)17/h2-14H2,1H3,(H2,15,16,17)
Affinity DataKi:  3.55E+3nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 2 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148435(CHEMBL119116 | [3-(3,5-Dichloro-4-octyloxy-benzyla...)
Show SMILES CCCCCCCCOc1c(Cl)cc(CNCCCP(O)(O)=O)cc1Cl
Show InChI InChI=1S/C18H30Cl2NO4P/c1-2-3-4-5-6-7-10-25-18-16(19)12-15(13-17(18)20)14-21-9-8-11-26(22,23)24/h12-13,21H,2-11,14H2,1H3,(H2,22,23,24)
Affinity DataIC50: 6.60nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50271765(3-(4-{3-[4-(3-Carboxy-acryloylamino)-phenoxy]-phen...)
Show SMILES OC(=O)\C=C\C(=O)Nc1ccc(Oc2cccc(Oc3ccc(NC(=O)\C=C\C(O)=O)cc3)c2)cc1
Show InChI InChI=1S/C26H20N2O8/c29-23(12-14-25(31)32)27-17-4-8-19(9-5-17)35-21-2-1-3-22(16-21)36-20-10-6-18(7-11-20)28-24(30)13-15-26(33)34/h1-16H,(H,27,29)(H,28,30)(H,31,32)(H,33,34)/b14-12+,15-13+
Affinity DataIC50: 8.90nMAssay Description:Antagonist activity at LPA2 receptor (unknown origin) expressed in rat RH7777 cells assessed as inhibition of LPA-induced intracellular calcium conce...More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50271765(3-(4-{3-[4-(3-Carboxy-acryloylamino)-phenoxy]-phen...)
Show SMILES OC(=O)\C=C\C(=O)Nc1ccc(Oc2cccc(Oc3ccc(NC(=O)\C=C\C(O)=O)cc3)c2)cc1
Show InChI InChI=1S/C26H20N2O8/c29-23(12-14-25(31)32)27-17-4-8-19(9-5-17)35-21-2-1-3-22(16-21)36-20-10-6-18(7-11-20)28-24(30)13-15-26(33)34/h1-16H,(H,27,29)(H,28,30)(H,31,32)(H,33,34)/b14-12+,15-13+
Affinity DataIC50: 9nMAssay Description:Antagonist activity at LPA2 receptor expressed in rat RH7777 cells assessed as inhibition of LPA-induced intracellular calcium responseMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148432(CHEMBL119440 | [3-(3,5-Dimethyl-4-octyloxy-benzyla...)
Show SMILES CCCCCCCCOc1c(C)cc(CNCCCP(O)(O)=O)cc1C
Show InChI InChI=1S/C20H36NO4P/c1-4-5-6-7-8-9-12-25-20-17(2)14-19(15-18(20)3)16-21-11-10-13-26(22,23)24/h14-15,21H,4-13,16H2,1-3H3,(H2,22,23,24)
Affinity DataIC50: 15nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50373826(CHEMBL256470)
Show SMILES C[C@@H](CN1CCN(CC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1)Nc1ncnc2c(C)csc12
Show InChI InChI=1S/C20H23Cl2N5O2S2/c1-13-11-30-19-18(13)23-12-24-20(19)25-14(2)10-26-5-7-27(8-6-26)31(28,29)15-3-4-16(21)17(22)9-15/h3-4,9,11-12,14H,5-8,10H2,1-2H3,(H,23,24,25)/t14-/m0/s1
Affinity DataIC50: 17nMAssay Description:Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assayMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148427(CHEMBL441826 | [3-(3-Bromo-4-decyloxy-5-methoxy-be...)
Show SMILES CCCCCCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1OC
Show InChI InChI=1S/C21H37BrNO5P/c1-3-4-5-6-7-8-9-10-13-28-21-19(22)15-18(16-20(21)27-2)17-23-12-11-14-29(24,25)26/h15-16,23H,3-14,17H2,1-2H3,(H2,24,25,26)
Affinity DataIC50: 18nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50271763(3-[3-(3-Carboxy-acryloylamino)-phenylcarbamoyl]-ac...)
Show SMILES OC(=O)\C=C\C(=O)Nc1cccc(NC(=O)\C=C\C(O)=O)c1
Show InChI InChI=1S/C14H12N2O6/c17-11(4-6-13(19)20)15-9-2-1-3-10(8-9)16-12(18)5-7-14(21)22/h1-8H,(H,15,17)(H,16,18)(H,19,20)(H,21,22)/b6-4+,7-5+
Affinity DataIC50: 21.8nMAssay Description:Antagonist activity at LPA2 receptor (unknown origin) expressed in rat RH7777 cells assessed as inhibition of LPA-induced intracellular calcium conce...More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50271763(3-[3-(3-Carboxy-acryloylamino)-phenylcarbamoyl]-ac...)
Show SMILES OC(=O)\C=C\C(=O)Nc1cccc(NC(=O)\C=C\C(O)=O)c1
Show InChI InChI=1S/C14H12N2O6/c17-11(4-6-13(19)20)15-9-2-1-3-10(8-9)16-12(18)5-7-14(21)22/h1-8H,(H,15,17)(H,16,18)(H,19,20)(H,21,22)/b6-4+,7-5+
Affinity DataIC50: 22nMAssay Description:Antagonist activity at LPA2 receptor expressed in rat RH7777 cells assessed as inhibition of LPA-induced intracellular calcium responseMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148414(CHEMBL332667 | [3-(3,5-Dibromo-4-octyloxy-benzylam...)
Show SMILES CCCCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1Br
Show InChI InChI=1S/C18H30Br2NO4P/c1-2-3-4-5-6-7-10-25-18-16(19)12-15(13-17(18)20)14-21-9-8-11-26(22,23)24/h12-13,21H,2-11,14H2,1H3,(H2,22,23,24)
Affinity DataIC50: 23nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148418(CHEMBL119256 | [3-(4-Octyl-benzylamino)-propyl]-ph...)
Show SMILES CCCCCCCCc1ccc(CNCCCP(O)(O)=O)cc1
Show InChI InChI=1S/C18H32NO3P/c1-2-3-4-5-6-7-9-17-10-12-18(13-11-17)16-19-14-8-15-23(20,21)22/h10-13,19H,2-9,14-16H2,1H3,(H2,20,21,22)
Affinity DataIC50: 26nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50271764(3-[4'-(3-Carboxy-acryloylamino)-biphenyl-4-ylcarba...)
Show SMILES OC(=O)\C=C\C(=O)Nc1ccc(cc1)-c1ccc(NC(=O)\C=C\C(O)=O)cc1
Show InChI InChI=1S/C20H16N2O6/c23-17(9-11-19(25)26)21-15-5-1-13(2-6-15)14-3-7-16(8-4-14)22-18(24)10-12-20(27)28/h1-12H,(H,21,23)(H,22,24)(H,25,26)(H,27,28)/b11-9+,12-10+
Affinity DataIC50: 28.3nMAssay Description:Antagonist activity at LPA2 receptor (unknown origin) expressed in rat RH7777 cells assessed as inhibition of LPA-induced intracellular calcium conce...More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148430(CHEMBL331054 | [3-(3-Methyl-4-octyloxy-benzylamino...)
Show SMILES CCCCCCCCOc1ccc(CNCCCP(O)(O)=O)cc1C
Show InChI InChI=1S/C19H34NO4P/c1-3-4-5-6-7-8-13-24-19-11-10-18(15-17(19)2)16-20-12-9-14-25(21,22)23/h10-11,15,20H,3-9,12-14,16H2,1-2H3,(H2,21,22,23)
Affinity DataIC50: 32nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148423(CHEMBL118783 | [3-(3-Bromo-4-heptyloxy-5-methoxy-b...)
Show SMILES CCCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1OC
Show InChI InChI=1S/C18H31BrNO5P/c1-3-4-5-6-7-10-25-18-16(19)12-15(13-17(18)24-2)14-20-9-8-11-26(21,22)23/h12-13,20H,3-11,14H2,1-2H3,(H2,21,22,23)
Affinity DataIC50: 33nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50373827(CHEMBL270865)
Show SMILES C[C@@H](CN1CCN(CC1)S(=O)(=O)c1cccc(Cl)c1)Nc1ncnc2c(C)csc12
Show InChI InChI=1S/C20H24ClN5O2S2/c1-14-12-29-19-18(14)22-13-23-20(19)24-15(2)11-25-6-8-26(9-7-25)30(27,28)17-5-3-4-16(21)10-17/h3-5,10,12-13,15H,6-9,11H2,1-2H3,(H,22,23,24)/t15-/m0/s1
Affinity DataIC50: 35nMAssay Description:Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assayMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148438(CHEMBL119354 | [3-(3-Bromo-4-octyloxy-benzylamino)...)
Show SMILES CCCCCCCCOc1ccc(CNCCCP(O)(O)=O)cc1Br
Show InChI InChI=1S/C18H31BrNO4P/c1-2-3-4-5-6-7-12-24-18-10-9-16(14-17(18)19)15-20-11-8-13-25(21,22)23/h9-10,14,20H,2-8,11-13,15H2,1H3,(H2,21,22,23)
Affinity DataIC50: 36nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148394(CHEMBL118860 | [3-(4-Nonyl-benzylamino)-propyl]-ph...)
Show SMILES CCCCCCCCCc1ccc(CNCCCP(O)(O)=O)cc1
Show InChI InChI=1S/C19H34NO3P/c1-2-3-4-5-6-7-8-10-18-11-13-19(14-12-18)17-20-15-9-16-24(21,22)23/h11-14,20H,2-10,15-17H2,1H3,(H2,21,22,23)
Affinity DataIC50: 40nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148424(CHEMBL118815 | [3-(3-Bromo-5-methoxy-4-undecyloxy-...)
Show SMILES CCCCCCCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1OC
Show InChI InChI=1S/C22H39BrNO5P/c1-3-4-5-6-7-8-9-10-11-14-29-22-20(23)16-19(17-21(22)28-2)18-24-13-12-15-30(25,26)27/h16-17,24H,3-15,18H2,1-2H3,(H2,25,26,27)
Affinity DataIC50: 42nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148421(CHEMBL119413 | [3-(3-Chloro-4-octyloxy-benzylamino...)
Show SMILES CCCCCCCCOc1ccc(CNCCCP(O)(O)=O)cc1Cl
Show InChI InChI=1S/C18H31ClNO4P/c1-2-3-4-5-6-7-12-24-18-10-9-16(14-17(18)19)15-20-11-8-13-25(21,22)23/h9-10,14,20H,2-8,11-13,15H2,1H3,(H2,21,22,23)
Affinity DataIC50: 55nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148420(CHEMBL117715 | [3-(3-Chloro-5-methoxy-4-octyloxy-b...)
Show SMILES CCCCCCCCOc1c(Cl)cc(CNCCCP(O)(O)=O)cc1OC
Show InChI InChI=1S/C19H33ClNO5P/c1-3-4-5-6-7-8-11-26-19-17(20)13-16(14-18(19)25-2)15-21-10-9-12-27(22,23)24/h13-14,21H,3-12,15H2,1-2H3,(H2,22,23,24)
Affinity DataIC50: 57nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148425(CHEMBL119873 | [3-(3-Fluoro-4-octyloxy-benzylamino...)
Show SMILES CCCCCCCCOc1ccc(CNCCCP(O)(O)=O)cc1F
Show InChI InChI=1S/C18H31FNO4P/c1-2-3-4-5-6-7-12-24-18-10-9-16(14-17(18)19)15-20-11-8-13-25(21,22)23/h9-10,14,20H,2-8,11-13,15H2,1H3,(H2,21,22,23)
Affinity DataIC50: 59nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148433(CHEMBL333335 | [3-(4-Nonyloxy-benzylamino)-propyl]...)
Show SMILES CCCCCCCCCOc1ccc(CNCCCP(O)(O)=O)cc1
Show InChI InChI=1S/C19H34NO4P/c1-2-3-4-5-6-7-8-15-24-19-12-10-18(11-13-19)17-20-14-9-16-25(21,22)23/h10-13,20H,2-9,14-17H2,1H3,(H2,21,22,23)
Affinity DataIC50: 74nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148439(3-(3-bromo-5-methoxy-4-(octyloxy)benzylamino)propy...)
Show SMILES CCCCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1OC
Show InChI InChI=1S/C19H33BrNO5P/c1-3-4-5-6-7-8-11-26-19-17(20)13-16(14-18(19)25-2)15-21-10-9-12-27(22,23)24/h13-14,21H,3-12,15H2,1-2H3,(H2,22,23,24)
Affinity DataIC50: 80nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148419(CHEMBL432813 | [3-(3-Methoxy-5-methyl-4-octyloxy-b...)
Show SMILES CCCCCCCCOc1c(C)cc(CNCCCP(O)(O)=O)cc1OC
Show InChI InChI=1S/C20H36NO5P/c1-4-5-6-7-8-9-12-26-20-17(2)14-18(15-19(20)25-3)16-21-11-10-13-27(22,23)24/h14-15,21H,4-13,16H2,1-3H3,(H2,22,23,24)
Affinity DataIC50: 89nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148426(CHEMBL323617 | {3-[4-(5-Heptyl-[1,2,4]oxadiazol-3-...)
Show SMILES CCCCCCCc1nc(no1)-c1ccc(CNCCCP(O)(O)=O)cc1
Show InChI InChI=1S/C19H30N3O4P/c1-2-3-4-5-6-8-18-21-19(22-26-18)17-11-9-16(10-12-17)15-20-13-7-14-27(23,24)25/h9-12,20H,2-8,13-15H2,1H3,(H2,23,24,25)
Affinity DataIC50: 120nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148413(CHEMBL116981 | {3-[(4'-Hexyl-biphenyl-4-ylmethyl)-...)
Show SMILES CCCCCCc1ccc(cc1)-c1ccc(CNCCCP(O)(O)=O)cc1
Show InChI InChI=1S/C22H32NO3P/c1-2-3-4-5-7-19-8-12-21(13-9-19)22-14-10-20(11-15-22)18-23-16-6-17-27(24,25)26/h8-15,23H,2-7,16-18H2,1H3,(H2,24,25,26)
Affinity DataIC50: 120nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50373815(CHEMBL401756)
Show SMILES C[C@@H](CN1CCN(CC1)S(=O)(=O)c1ccc(C)cc1)Nc1ncnc2c(C)csc12
Show InChI InChI=1S/C21H27N5O2S2/c1-15-4-6-18(7-5-15)30(27,28)26-10-8-25(9-11-26)12-17(3)24-21-20-19(22-14-23-21)16(2)13-29-20/h4-7,13-14,17H,8-12H2,1-3H3,(H,22,23,24)/t17-/m0/s1
Affinity DataIC50: 170nMAssay Description:Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assayMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148416(CHEMBL115970 | [3-(4-Nonanoyl-benzylamino)-propyl]...)
Show SMILES CCCCCCCCC(=O)c1ccc(CNCCCP(O)(O)=O)cc1
Show InChI InChI=1S/C19H32NO4P/c1-2-3-4-5-6-7-9-19(21)18-12-10-17(11-13-18)16-20-14-8-15-25(22,23)24/h10-13,20H,2-9,14-16H2,1H3,(H2,22,23,24)
Affinity DataIC50: 250nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50373817(CHEMBL404452)
Show SMILES C[C@@H](CN1CCN(CC1)c1ccccc1C)Nc1ncnc2c(C)csc12
Show InChI InChI=1S/C21H27N5S/c1-15-6-4-5-7-18(15)26-10-8-25(9-11-26)12-17(3)24-21-20-19(22-14-23-21)16(2)13-27-20/h4-7,13-14,17H,8-12H2,1-3H3,(H,22,23,24)/t17-/m0/s1
Affinity DataIC50: 260nMAssay Description:Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assayMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148428(CHEMBL325247 | [3-(3-Bromo-4-hexyloxy-5-methoxy-be...)
Show SMILES CCCCCCOc1c(Br)cc(CNCCCP(O)(O)=O)cc1OC
Show InChI InChI=1S/C17H29BrNO5P/c1-3-4-5-6-9-24-17-15(18)11-14(12-16(17)23-2)13-19-8-7-10-25(20,21)22/h11-12,19H,3-10,13H2,1-2H3,(H2,20,21,22)
Affinity DataIC50: 260nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148436(CHEMBL119382 | {3-[4-(2-Heptyl-2H-tetrazol-5-yl)-b...)
Show SMILES CCCCCCCn1nnc(n1)-c1ccc(CNCCCP(O)(O)=O)cc1
Show InChI InChI=1S/C18H30N5O3P/c1-2-3-4-5-6-13-23-21-18(20-22-23)17-10-8-16(9-11-17)15-19-12-7-14-27(24,25)26/h8-11,19H,2-7,12-15H2,1H3,(H2,24,25,26)
Affinity DataIC50: 270nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50373828(CHEMBL427893)
Show SMILES C[C@@H](CN1CCN(CC1)S(=O)(=O)c1cccc(C)c1)Nc1ncnc2c(C)csc12
Show InChI InChI=1S/C21H27N5O2S2/c1-15-5-4-6-18(11-15)30(27,28)26-9-7-25(8-10-26)12-17(3)24-21-20-19(22-14-23-21)16(2)13-29-20/h4-6,11,13-14,17H,7-10,12H2,1-3H3,(H,22,23,24)/t17-/m0/s1
Affinity DataIC50: 310nMAssay Description:Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assayMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50271701(2,6-bis(3-carboxyacrylamido)benzoic acid | 4,4'-(2...)
Show SMILES OC(=O)\C=C\C(=O)Nc1cccc(NC(=O)\C=C\C(O)=O)c1C(O)=O
Show InChI InChI=1S/C15H12N2O8/c18-10(4-6-12(20)21)16-8-2-1-3-9(14(8)15(24)25)17-11(19)5-7-13(22)23/h1-7H,(H,16,18)(H,17,19)(H,20,21)(H,22,23)(H,24,25)/b6-4+,7-5+
Affinity DataIC50: 355nMAssay Description:Antagonist activity at LPA2 receptor (unknown origin) expressed in rat RH7777 cells assessed as inhibition of LPA-induced intracellular calcium conce...More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50271701(2,6-bis(3-carboxyacrylamido)benzoic acid | 4,4'-(2...)
Show SMILES OC(=O)\C=C\C(=O)Nc1cccc(NC(=O)\C=C\C(O)=O)c1C(O)=O
Show InChI InChI=1S/C15H12N2O8/c18-10(4-6-12(20)21)16-8-2-1-3-9(14(8)15(24)25)17-11(19)5-7-13(22)23/h1-7H,(H,16,18)(H,17,19)(H,20,21)(H,22,23)(H,24,25)/b6-4+,7-5+
Affinity DataIC50: 355nMAssay Description:Antagonist activity at LPA2 receptor expressed in rat RH7777 cells assessed as inhibition of LPA-induced intracellular calcium responseMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148431(CHEMBL324820 | [3-(3-Ethoxy-4-octyloxy-benzylamino...)
Show SMILES CCCCCCCCOc1ccc(CNCCCP(O)(O)=O)cc1OCC
Show InChI InChI=1S/C20H36NO5P/c1-3-5-6-7-8-9-14-26-19-12-11-18(16-20(19)25-4-2)17-21-13-10-15-27(22,23)24/h11-12,16,21H,3-10,13-15,17H2,1-2H3,(H2,22,23,24)
Affinity DataIC50: 420nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148429(CHEMBL118508 | [3-(3-Methoxy-4-octyloxy-benzylamin...)
Show SMILES CCCCCCCCOc1ccc(CNCCCP(O)(O)=O)cc1OC
Show InChI InChI=1S/C19H34NO5P/c1-3-4-5-6-7-8-13-25-18-11-10-17(15-19(18)24-2)16-20-12-9-14-26(21,22)23/h10-11,15,20H,3-9,12-14,16H2,1-2H3,(H2,21,22,23)
Affinity DataIC50: 450nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148437(CHEMBL332373 | [3-(4-Octyloxy-benzylamino)-propyl]...)
Show SMILES CCCCCCCCOc1ccc(CNCCCP(O)(O)=O)cc1
Show InChI InChI=1S/C18H32NO4P/c1-2-3-4-5-6-7-14-23-18-11-9-17(10-12-18)16-19-13-8-15-24(20,21)22/h9-12,19H,2-8,13-16H2,1H3,(H2,20,21,22)
Affinity DataIC50: 530nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50148422(4-[(3-Phosphono-propylamino)-methyl]-benzoic acid ...)
Show SMILES CCCCCCCOC(=O)c1ccc(CNCCCP(O)(O)=O)cc1
Show InChI InChI=1S/C18H30NO5P/c1-2-3-4-5-6-13-24-18(20)17-10-8-16(9-11-17)15-19-12-7-14-25(21,22)23/h8-11,19H,2-7,12-15H2,1H3,(H2,21,22,23)
Affinity DataIC50: 700nMAssay Description:Binding affinity to human sphingosine 1-phosphate receptor 4 expressed in CHO cells was determined by using [33P]-S1P as radioligandMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50373821(CHEMBL401747)
Show SMILES C[C@@H](CN1CCN(CC1)c1ccccc1C)Nc1nc(nc2ccccc12)C(F)(F)F
Show InChI InChI=1S/C23H26F3N5/c1-16-7-3-6-10-20(16)31-13-11-30(12-14-31)15-17(2)27-21-18-8-4-5-9-19(18)28-22(29-21)23(24,25)26/h3-10,17H,11-15H2,1-2H3,(H,27,28,29)/t17-/m0/s1
Affinity DataIC50: 730nMAssay Description:Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assayMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50373829(CHEMBL429681)
Show SMILES C[C@@H](CN1CCN(CC1)S(=O)(=O)c1ccccc1C)Nc1ncnc2c(C)csc12
Show InChI InChI=1S/C21H27N5O2S2/c1-15-6-4-5-7-18(15)30(27,28)26-10-8-25(9-11-26)12-17(3)24-21-20-19(22-14-23-21)16(2)13-29-20/h4-7,13-14,17H,8-12H2,1-3H3,(H,22,23,24)/t17-/m0/s1
Affinity DataIC50: 730nMAssay Description:Antagonist activity at LPA2 expressed in RH7777 cells with Gi4-protein and aequorin by calcium mobilization assayMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50195700(CHEMBL3975893)
Show SMILES COc1cc(cc(OC)c1C)C(=O)N(CCCc1ccccc1)Cc1ccc(Oc2ccc(Cl)cc2C(O)=O)cc1
Show InChI InChI=1S/C33H32ClNO6/c1-22-30(39-2)18-25(19-31(22)40-3)32(36)35(17-7-10-23-8-5-4-6-9-23)21-24-11-14-27(15-12-24)41-29-16-13-26(34)20-28(29)33(37)38/h4-6,8-9,11-16,18-20H,7,10,17,21H2,1-3H3,(H,37,38)
Affinity DataIC50: 790nMAssay Description:Inhibition of LPA2 (unknown origin)More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50065615(CHEMBL3401387)
Show SMILES CCC(CC)CC1(O)CCN(CC1)C(=O)Nc1cc(Oc2ccc(F)cc2)cc(Oc2ccc(cc2)C(=O)N(C)C)c1
Show InChI InChI=1S/C33H40FN3O5/c1-5-23(6-2)22-33(40)15-17-37(18-16-33)32(39)35-26-19-29(21-30(20-26)42-28-13-9-25(34)10-14-28)41-27-11-7-24(8-12-27)31(38)36(3)4/h7-14,19-21,23,40H,5-6,15-18,22H2,1-4H3,(H,35,39)
Affinity DataIC50: 800nMAssay Description:Antagonist activity at human LPA2 receptor overexpressed in CHO cells assessed as increase in intracellular calcium ion concentration after 3 mins by...More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50065614(CHEMBL3401386)
Show SMILES CCC(CC)CC1(O)CCN(CC1)C(=O)Nc1cc(Oc2ccc(F)cc2)cc(Oc2ccc(cc2)C(=O)NC)c1
Show InChI InChI=1S/C32H38FN3O5/c1-4-22(5-2)21-32(39)14-16-36(17-15-32)31(38)35-25-18-28(40-26-10-6-23(7-11-26)30(37)34-3)20-29(19-25)41-27-12-8-24(33)9-13-27/h6-13,18-20,22,39H,4-5,14-17,21H2,1-3H3,(H,34,37)(H,35,38)
Affinity DataIC50: 800nMAssay Description:Antagonist activity at human LPA2 receptor overexpressed in CHO cells assessed as increase in intracellular calcium ion concentration after 3 mins by...More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50065613(CHEMBL3401385)
Show SMILES CCC(CC)CC1(O)CCN(CC1)C(=O)Nc1cc(Oc2ccc(F)cc2)cc(Oc2ccccc2C(N)=O)c1
Show InChI InChI=1S/C31H36FN3O5/c1-3-21(4-2)20-31(38)13-15-35(16-14-31)30(37)34-23-17-25(39-24-11-9-22(32)10-12-24)19-26(18-23)40-28-8-6-5-7-27(28)29(33)36/h5-12,17-19,21,38H,3-4,13-16,20H2,1-2H3,(H2,33,36)(H,34,37)
Affinity DataIC50: 800nMAssay Description:Antagonist activity at human LPA2 receptor overexpressed in CHO cells assessed as increase in intracellular calcium ion concentration after 3 mins by...More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 2(Homo sapiens (Human))
The University of Memphis

Curated by ChEMBL
LigandPNGBDBM50065612(CHEMBL3401384)
Show SMILES CCC(CC)CC1(O)CCN(CC1)C(=O)Nc1cc(Oc2ccc(F)cc2)cc(Oc2cccc(c2)C(N)=O)c1
Show InChI InChI=1S/C31H36FN3O5/c1-3-21(4-2)20-31(38)12-14-35(15-13-31)30(37)34-24-17-27(39-25-10-8-23(32)9-11-25)19-28(18-24)40-26-7-5-6-22(16-26)29(33)36/h5-11,16-19,21,38H,3-4,12-15,20H2,1-2H3,(H2,33,36)(H,34,37)
Affinity DataIC50: 800nMAssay Description:Antagonist activity at human LPA2 receptor overexpressed in CHO cells assessed as increase in intracellular calcium ion concentration after 3 mins by...More data for this Ligand-Target Pair
Displayed 1 to 50 (of 141 total ) | Next | Last >>
Jump to: