Compile Data Set for Download or QSAR
Found 268 Enz. Inhib. hit(s) with Target = 'Lysophosphatidic acid receptor 3'
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50176394(CHEMBL202361 | octanoic acid (R)-2-octanoyloxy-3-t...)
Show SMILES CCCCCCCC(=O)OC[C@H](COP(O)(O)=S)OC(=O)CCCCCCC
Show InChI InChI=1S/C19H37O7PS/c1-3-5-7-9-11-13-18(20)24-15-17(16-25-27(22,23)28)26-19(21)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3,(H2,22,23,28)/t17-/m1/s1
Affinity DataKi:  5nMAssay Description:Activity at LPA3 receptor transfected RH7777 cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170852(CHEMBL187402 | Thiophosphoric acid (E)-tetradec-9-...)
Show SMILES CCCC\C=C\CCCCCCCCOP(O)(O)=S
Show InChI InChI=1S/C14H29O3PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-18(15,16)19/h5-6H,2-4,7-14H2,1H3,(H2,15,16,19)/b6-5+
Affinity DataKi:  14nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170847(CHEMBL190484 | Thiophosphoric acid (E)-dodec-9-eny...)
Show SMILES CC\C=C\CCCCCCCCOP(O)(O)=S
Show InChI InChI=1S/C12H25O3PS/c1-2-3-4-5-6-7-8-9-10-11-12-15-16(13,14)17/h3-4H,2,5-12H2,1H3,(H2,13,14,17)/b4-3+
Affinity DataKi:  14nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170860(CHEMBL191365 | Thiophosphoric acid dodecyl ester)
Show SMILES CCCCCCCCCCCCOP(O)(O)=S
Show InChI InChI=1S/C12H27O3PS/c1-2-3-4-5-6-7-8-9-10-11-12-15-16(13,14)17/h2-12H2,1H3,(H2,13,14,17)
Affinity DataKi:  14nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170858(CHEMBL190349 | Phosphoric acid mono-((E)-dodec-9-e...)
Show SMILES CC\C=C\CCCCCCCCOP(O)(O)=O
Show InChI InChI=1S/C12H25O4P/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h3-4H,2,5-12H2,1H3,(H2,13,14,15)/b4-3+
Affinity DataKi:  27nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50149996(CHEMBL183143 | Phosphoric acid mono-[3-[4-(4-ethox...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](COP(O)(O)=O)Cc1ccc(OCc2cc(OCC)ccn2)cc1
Show InChI InChI=1S/C35H55N2O7P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-35(38)37-32(29-44-45(39,40)41)26-30-20-22-33(23-21-30)43-28-31-27-34(42-4-2)24-25-36-31/h11-12,20-25,27,32H,3-10,13-19,26,28-29H2,1-2H3,(H,37,38)(H2,39,40,41)/b12-11-/t32-/m1/s1
Affinity DataKi:  39nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50176391(CHEMBL202185 | octanoic acid (R)-2-octanoyloxy-3-p...)
Show SMILES CCCCCCCC(=O)OC[C@H](COP(O)(O)=O)OC(=O)CCCCCCC
Show InChI InChI=1S/C19H37O8P/c1-3-5-7-9-11-13-18(20)25-15-17(16-26-28(22,23)24)27-19(21)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3,(H2,22,23,24)/t17-/m1/s1
Affinity DataKi:  39nMAssay Description:Activity at LPA3 receptor transfected RH7777 cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50149997(CHEMBL362053 | Phosphoric acid mono-[3-[4-(4-metho...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](COP(O)(O)=O)Cc1ccc(OCc2ncc(C)c(OC)c2C)cc1
Show InChI InChI=1S/C36H57N2O7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-35(39)38-32(27-45-46(40,41)42)25-31-21-23-33(24-22-31)44-28-34-30(3)36(43-4)29(2)26-37-34/h12-13,21-24,26,32H,5-11,14-20,25,27-28H2,1-4H3,(H,38,39)(H2,40,41,42)/b13-12-/t32-/m1/s1
Affinity DataKi:  39nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170851(CHEMBL188591 | Phosphoric acid mono-((E)-tetradec-...)
Show SMILES CC\C=C\CCCCCCCCCCOP(O)(O)=O
Show InChI InChI=1S/C14H29O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-19(15,16)17/h3-4H,2,5-14H2,1H3,(H2,15,16,17)/b4-3+
Affinity DataKi:  40nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50150007(CHEMBL183221 | Phosphoric acid mono-((R)-2-((Z)-oc...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](COP(O)(O)=O)Cc1ccc(OCc2cc(OCC(F)(F)F)ccn2)cc1
Show InChI InChI=1S/C35H52F3N2O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-34(41)40-31(27-47-48(42,43)44)24-29-18-20-32(21-19-29)45-26-30-25-33(22-23-39-30)46-28-35(36,37)38/h9-10,18-23,25,31H,2-8,11-17,24,26-28H2,1H3,(H,40,41)(H2,42,43,44)/b10-9-/t31-/m1/s1
Affinity DataKi:  48nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50496698(CHEMBL3218459)
Show SMILES CCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP(O)(O)=O)Cc1ccc(OCc2cc(OCC(F)(F)F)ccn2)cc1
Show InChI InChI=1S/C35H54F3N2O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-34(41)40-31(27-47-48(42,43)44)24-29-18-20-32(21-19-29)45-26-30-25-33(22-23-39-30)46-28-35(36,37)38/h18-23,25,31H,2-17,24,26-28H2,1H3,(H,40,41)(H2,42,43,44)/t31-/m1/s1
Affinity DataKi:  48nMAssay Description:Competitive antagonist activity at N-terminal 3XHA-tagged human LPA3 receptor overexpressed in CHO cells assessed as inhibition of LPA-induced [35S]G...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170857(CHEMBL187795 | Thiophosphoric acid decyl ester)
Show SMILES CCCCCCCCCCOP(O)(O)=S
Show InChI InChI=1S/C10H23O3PS/c1-2-3-4-5-6-7-8-9-10-13-14(11,12)15/h2-10H2,1H3,(H2,11,12,15)
Affinity DataKi:  49nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50176397(CHEMBL203986 | nonanoic acid (S)-2-nonanoyloxy-3-p...)
Show SMILES CCCCCCCCOC[C@@H](COP(O)(O)=O)OCCCCCCCC
Show InChI InChI=1S/C19H41O6P/c1-3-5-7-9-11-13-15-23-17-19(18-25-26(20,21)22)24-16-14-12-10-8-6-4-2/h19H,3-18H2,1-2H3,(H2,20,21,22)/t19-/m0/s1
Affinity DataKi:  50nMAssay Description:Activity at LPA3 receptor transfected RH7777 cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170843(CHEMBL190430 | Phosphoric acid mono-((E)-tetradec-...)
Show SMILES CCCC\C=C\CCCCCCCCOP(O)(O)=O
Show InChI InChI=1S/C14H29O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-19(15,16)17/h5-6H,2-4,7-14H2,1H3,(H2,15,16,17)/b6-5+
Affinity DataKi:  58nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170849(CHEMBL189296 | Thiophosphoric acid tetradecyl este...)
Show SMILES CCCCCCCCCCCCCCOP(O)(O)=S
Show InChI InChI=1S/C14H31O3PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-18(15,16)19/h2-14H2,1H3,(H2,15,16,19)
Affinity DataKi:  76nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Rattus norvegicus)
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50177339(CHEMBL436763 | potassium ((2R,4R)-2-(heptadec-9-en...)
Show SMILES CCCCCCC\C=C\CCCCCCCC[C@@H]1OC[C@H](COP(O)([O-])=O)O1
Show InChI InChI=1S/C21H41O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25-18-20(27-21)19-26-28(22,23)24/h8-9,20-21H,2-7,10-19H2,1H3,(H2,22,23,24)/p-1/b9-8+/t20-,21-/m1/s1
Affinity DataKi:  83nMAssay Description:Activity at LPA3 receptor in RH7777 rat hepatoma cell lineMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50150010(CHEMBL265967 | Phosphoric acid mono-[(R)-3-[4-(4-m...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](COP(O)(O)=O)Cc1ccc(OCc2cc(OC)ccn2)cc1
Show InChI InChI=1S/C34H53N2O7P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-34(37)36-31(28-43-44(38,39)40)25-29-19-21-32(22-20-29)42-27-30-26-33(41-2)23-24-35-30/h10-11,19-24,26,31H,3-9,12-18,25,27-28H2,1-2H3,(H,36,37)(H2,38,39,40)/b11-10-/t31-/m1/s1
Affinity DataKi:  102nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50176392(CHEMBL379248 | thiophosphoric acid (R)-2-octanoyla...)
Show SMILES CCCCCCCCNC(=O)[C@@H](COP(O)(O)=S)NC(=O)CCCCCCC
Show InChI InChI=1S/C19H39N2O5PS/c1-3-5-7-9-11-13-15-20-19(23)17(16-26-27(24,25)28)21-18(22)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3,(H,20,23)(H,21,22)(H2,24,25,28)/t17-/m1/s1
Affinity DataKi:  118nMAssay Description:Activity at LPA3 receptor transfected RH7777 cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50176393(CHEMBL383095 | octanoic acid (S)-2-octanoyloxy-3-p...)
Show SMILES CCCCCCCC(=O)OC[C@@H](COP(O)(O)=O)OC(=O)CCCCCCC
Show InChI InChI=1S/C19H37O8P/c1-3-5-7-9-11-13-18(20)25-15-17(16-26-28(22,23)24)27-19(21)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3,(H2,22,23,24)/t17-/m0/s1
Affinity DataKi:  119nMAssay Description:Activity at LPA3 receptor transfected RH7777 cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170850(CHEMBL361255 | Phosphoric acid monodecyl ester)
Show SMILES CCCCCCCCCCOP(O)(O)=O
Show InChI InChI=1S/C10H23O4P/c1-2-3-4-5-6-7-8-9-10-14-15(11,12)13/h2-10H2,1H3,(H2,11,12,13)
Affinity DataKi:  121nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170854(CHEMBL187711 | Phosphoric acid monododecyl ester)
Show SMILES CCCCCCCCCCCCOP(O)(O)=O
Show InChI InChI=1S/C12H27O4P/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h2-12H2,1H3,(H2,13,14,15)
Affinity DataKi:  121nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170855(CHEMBL363935 | Thiophosphoric acid dec-9-enyl este...)
Show SMILES OP(O)(=S)OCCCCCCCCC=C
Show InChI InChI=1S/C10H21O3PS/c1-2-3-4-5-6-7-8-9-10-13-14(11,12)15/h2H,1,3-10H2,(H2,11,12,15)
Affinity DataKi:  128nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170859(3-(4-(4-((1-(2-chlorophenyl)ethoxy)carbonyl)-3-met...)
Show SMILES CC(OC(=O)Nc1c(C)noc1-c1ccc(CSCCC(O)=O)cc1)c1ccccc1Cl
Show InChI InChI=1S/C23H23ClN2O5S/c1-14-21(25-23(29)30-15(2)18-5-3-4-6-19(18)24)22(31-26-14)17-9-7-16(8-10-17)13-32-12-11-20(27)28/h3-10,15H,11-13H2,1-2H3,(H,25,29)(H,27,28)
Affinity DataKi:  148nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50150008(CHEMBL182773 | [4-[4-(4-Methoxy-3,5-dimethyl-pyrid...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](CCP(O)(O)=O)Cc1ccc(OCc2ncc(C)c(OC)c2C)cc1
Show InChI InChI=1S/C37H59N2O6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-36(40)39-33(25-26-46(41,42)43)27-32-21-23-34(24-22-32)45-29-35-31(3)37(44-4)30(2)28-38-35/h12-13,21-24,28,33H,5-11,14-20,25-27,29H2,1-4H3,(H,39,40)(H2,41,42,43)/b13-12-/t33-/m0/s1
Affinity DataKi:  150nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Rattus norvegicus)
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50177329(CHEMBL199380 | potassium (2-(6-(4-octylphenyl)hexy...)
Show SMILES CCCCCCCCc1ccc(CCCCCCC2OCC(COP(O)([O-])=O)O2)cc1
Show InChI InChI=1S/C24H41O6P/c1-2-3-4-5-6-9-12-21-15-17-22(18-16-21)13-10-7-8-11-14-24-28-19-23(30-24)20-29-31(25,26)27/h15-18,23-24H,2-14,19-20H2,1H3,(H2,25,26,27)/p-1
Affinity DataKi:  171nMAssay Description:Activity at LPA3 receptor in RH7777 rat hepatoma cell lineMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50146232(CHEMBL440696 | Phosphoric acid mono-{(R)-2-((Z)-oc...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](COP(O)(O)=O)Cc1ccc(OCc2ccccn2)cc1
Show InChI InChI=1S/C33H51N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-33(36)35-31(28-41-42(37,38)39)26-29-21-23-32(24-22-29)40-27-30-19-17-18-25-34-30/h9-10,17-19,21-25,31H,2-8,11-16,20,26-28H2,1H3,(H,35,36)(H2,37,38,39)/b10-9-/t31-/m1/s1
Affinity DataKi:  175nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50176396(CHEMBL204037 | Serine amide phospate derivative | ...)
Show SMILES CCCCCCCCNC(=O)[C@H](COP(O)(O)=O)NC(=O)CCCCCCC
Show InChI InChI=1S/C19H39N2O6P/c1-3-5-7-9-11-13-15-20-19(23)17(16-27-28(24,25)26)21-18(22)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3,(H,20,23)(H,21,22)(H2,24,25,26)/t17-/m0/s1
Affinity DataKi:  196nMAssay Description:Activity at LPA3 receptor transfected RH7777 cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170862(CHEMBL191055 | Octanoic acid (S)-1-methyl-2-octano...)
Show SMILES CCCCCCCC(=O)OC[C@H](COP(O)(=O)OP(O)(O)=O)OC(=O)CCCCCCC
Show InChI InChI=1S/C19H38O11P2/c1-3-5-7-9-11-13-18(20)27-15-17(16-28-32(25,26)30-31(22,23)24)29-19(21)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3,(H,25,26)(H2,22,23,24)/t17-/m1/s1
Affinity DataKi:  202nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170842(CHEMBL187633 | Phosphoric acid monotetradecyl este...)
Show SMILES CCCCCCCCCCCCCCOP(O)(O)=O
Show InChI InChI=1S/C14H31O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-19(15,16)17/h2-14H2,1H3,(H2,15,16,17)
Affinity DataKi:  211nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50304580(2-(3-(4-nitrophenoxy)phenyl)-1,3-dioxoisoindoline-...)
Show SMILES OC(=O)c1ccc2C(=O)N(C(=O)c2c1)c1cccc(Oc2ccc(cc2)[N+]([O-])=O)c1
Show InChI InChI=1S/C21H12N2O7/c24-19-17-9-4-12(21(26)27)10-18(17)20(25)22(19)14-2-1-3-16(11-14)30-15-7-5-13(6-8-15)23(28)29/h1-11H,(H,26,27)
Affinity DataKi:  230nMAssay Description:Binding affinity to LPA3More data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50149993(CHEMBL181612 | [4-(4-Benzyloxy-phenyl)-1-hydroxy-3...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](CC(=O)P(O)(O)O)Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C35H54NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-34(37)36-32(28-35(38)43(39,40)41)27-30-23-25-33(26-24-30)42-29-31-20-17-16-18-21-31/h9-10,16-18,20-21,23-26,32,39-41,43H,2-8,11-15,19,22,27-29H2,1H3,(H,36,37)/b10-9-/t32-/m0/s1
Affinity DataKi:  232nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Rattus norvegicus)
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50177340(CHEMBL382116 | potassium ((2R,4S)-2-(heptadec-9-en...)
Show SMILES CCCCCCC\C=C\CCCCCCCC[C@@H]1OC[C@@H](COP(O)([O-])=O)O1
Show InChI InChI=1S/C21H41O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25-18-20(27-21)19-26-28(22,23)24/h8-9,20-21H,2-7,10-19H2,1H3,(H2,22,23,24)/p-1/b9-8+/t20-,21+/m0/s1
Affinity DataKi:  241nMAssay Description:Activity at LPA3 receptor in RH7777 rat hepatoma cell lineMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170845(CHEMBL363067 | Dodecyl-phosphonic acid)
Show SMILES CCCCCCCCCCCCP(O)(O)=O
Show InChI InChI=1S/C12H27O3P/c1-2-3-4-5-6-7-8-9-10-11-12-16(13,14)15/h2-12H2,1H3,(H2,13,14,15)
Affinity DataKi:  303nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

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:  310nMAssay Description:Antagonist activity at LPA3 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 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50241460(4-(3-benzamidophenylamino)-4-oxobut-2-enoic acid |...)
Show SMILES OC(=O)\C=C/C(=O)Nc1cccc(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C17H14N2O4/c20-15(9-10-16(21)22)18-13-7-4-8-14(11-13)19-17(23)12-5-2-1-3-6-12/h1-11H,(H,18,20)(H,19,23)(H,21,22)/b10-9-
Affinity DataKi:  317nMAssay Description:Antagonist activity at LPA3 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 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170856(CHEMBL188081 | Phosphoric acid mono-((E)-dec-4-eny...)
Show SMILES CCCCC\C=C\CCCOP(O)(O)=O
Show InChI InChI=1S/C10H21O4P/c1-2-3-4-5-6-7-8-9-10-14-15(11,12)13/h6-7H,2-5,8-10H2,1H3,(H2,11,12,13)/b7-6+
Affinity DataKi:  370nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50150000(CHEMBL182446 | Phosphoric acid mono-[(R)-3-{4-[4-(...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](COP(O)(O)=O)Cc1ccc(OCc2cc(OCCOC)ccn2)cc1
Show InChI InChI=1S/C36H57N2O8P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-36(39)38-33(30-46-47(40,41)42)27-31-19-21-34(22-20-31)45-29-32-28-35(23-24-37-32)44-26-25-43-2/h10-11,19-24,28,33H,3-9,12-18,25-27,29-30H2,1-2H3,(H,38,39)(H2,40,41,42)/b11-10-/t33-/m1/s1
Affinity DataKi:  423nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50149998(CHEMBL185287 | Phosphoric acid mono-[(R)-3-[4-(6-m...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](COP(O)(O)=O)Cc1ccc(OCc2cccc(OC)n2)cc1
Show InChI InChI=1S/C34H53N2O7P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-33(37)35-31(28-43-44(38,39)40)26-29-22-24-32(25-23-29)42-27-30-19-18-21-34(36-30)41-2/h10-11,18-19,21-25,31H,3-9,12-17,20,26-28H2,1-2H3,(H,35,37)(H2,38,39,40)/b11-10-/t31-/m1/s1
Affinity DataKi:  455nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50176395(CHEMBL202251 | phosphoric acid mono-((R)-2-octanoy...)
Show SMILES CCCCCCCCNC(=O)[C@@H](COP(O)(O)=O)NC(=O)CCCCCCC
Show InChI InChI=1S/C19H39N2O6P/c1-3-5-7-9-11-13-15-20-19(23)17(16-27-28(24,25)26)21-18(22)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3,(H,20,23)(H,21,22)(H2,24,25,26)/t17-/m1/s1
Affinity DataKi:  489nMAssay Description:Activity at LPA3 receptor transfected RH7777 cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50176395(CHEMBL202251 | phosphoric acid mono-((R)-2-octanoy...)
Show SMILES CCCCCCCCNC(=O)[C@@H](COP(O)(O)=O)NC(=O)CCCCCCC
Show InChI InChI=1S/C19H39N2O6P/c1-3-5-7-9-11-13-15-20-19(23)17(16-27-28(24,25)26)21-18(22)14-12-10-8-6-4-2/h17H,3-16H2,1-2H3,(H,20,23)(H,21,22)(H2,24,25,26)/t17-/m1/s1
Affinity DataKi:  489nMAssay Description:Activity at LPA3 receptor transfected RH7777 cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170863(CHEMBL363776 | Phosphoric acid monodec-9-enyl este...)
Show SMILES OP(O)(=O)OCCCCCCCCC=C
Show InChI InChI=1S/C10H21O4P/c1-2-3-4-5-6-7-8-9-10-14-15(11,12)13/h2H,1,3-10H2,(H2,11,12,13)
Affinity DataKi:  504nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50496697(CHEMBL3218460)
Show SMILES CCCCCCCCCCCCCCCC(=O)N[C@H](Cc1ccc(OCc2cc(OCC(F)(F)F)ccn2)cc1)\C=C\P(O)(O)=O
Show InChI InChI=1S/C34H50F3N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-33(40)39-29(21-23-46(41,42)43)24-28-16-18-31(19-17-28)44-26-30-25-32(20-22-38-30)45-27-34(35,36)37/h16-23,25,29H,2-15,24,26-27H2,1H3,(H,39,40)(H2,41,42,43)/b23-21+/t29-/m0/s1
Affinity DataKi:  512nMAssay Description:Competitive antagonist activity at N-terminal 3XHA-tagged human LPA3 receptor overexpressed in CHO cells assessed as inhibition of LPA-induced [35S]G...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50150001(CHEMBL360131 | Phosphoric acid mono-{2-((Z)-(R)-oc...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](COP(O)(O)=O)Cc1ccc(OCc2ccc3ccccc3n2)cc1
Show InChI InChI=1S/C37H53N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-37(40)39-34(30-45-46(41,42)43)28-31-22-26-35(27-23-31)44-29-33-25-24-32-19-17-18-20-36(32)38-33/h9-10,17-20,22-27,34H,2-8,11-16,21,28-30H2,1H3,(H,39,40)(H2,41,42,43)/b10-9-/t34-/m1/s1
Affinity DataKi:  533nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50150009(CHEMBL181917 | Phosphoric acid mono-[(S)-3-[4-(4-m...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](COP(O)(O)=O)Cc1ccc(OCc2ncc(C)c(OC)c2C)cc1
Show InChI InChI=1S/C36H57N2O7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-35(39)38-32(27-45-46(40,41)42)25-31-21-23-33(24-22-31)44-28-34-30(3)36(43-4)29(2)26-37-34/h12-13,21-24,26,32H,5-11,14-20,25,27-28H2,1-4H3,(H,38,39)(H2,40,41,42)/b13-12-/t32-/m0/s1
Affinity DataKi:  561nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170861((1,1-Difluoro-pentadecyl)-phosphonic acid | CHEMBL...)
Show SMILES CCCCCCCCCCCCCCC(F)(F)P(O)(O)=O
Show InChI InChI=1S/C15H31F2O3P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16,17)21(18,19)20/h2-14H2,1H3,(H2,18,19,20)
Affinity DataKi:  575nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170841(CHEMBL191411 | Phosphoric acid mono-[(S)-3-(4-benz...)
Show SMILES CCCCCCCCCCCCCCCCCC(=O)N[C@H](COP(O)(O)=O)Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C34H54NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-34(36)35-32(29-41-42(37,38)39)27-30-23-25-33(26-24-30)40-28-31-20-17-16-18-21-31/h16-18,20-21,23-26,32H,2-15,19,22,27-29H2,1H3,(H,35,36)(H2,37,38,39)/t32-/m0/s1
Affinity DataKi:  588nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50193517(3-hydroxyl-4-oleoyloxylbutane 1,3-cyclic phosphono...)
Show SMILES CCCCCCCCCCCCCCCCCC(=O)OCC1CCP(O)(=S)O1
Show InChI InChI=1S/C22H43O4PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(23)25-20-21-18-19-27(24,28)26-21/h21H,2-20H2,1H3,(H,24,28)
Affinity DataKi:  636nMAssay Description:Activity at human LPA3 receptor expressed in RH7777 cells by calcium mobilization assayMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50170853(CHEMBL188083 | Decyl-phosphonic acid)
Show SMILES CCCCCCCCCCP(O)(O)=O
Show InChI InChI=1S/C10H23O3P/c1-2-3-4-5-6-7-8-9-10-14(11,12)13/h2-10H2,1H3,(H2,11,12,13)
Affinity DataKi:  680nMAssay Description:Binding affinity for Lysophosphatidic acid receptor 3 expressed in RH7777 rat hepatoma cellsMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50146230(CHEMBL314555 | Phosphoric acid mono-{(S)-2-((Z)-oc...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@H](COP(O)(O)=O)Cc1ccc(OCc2ccccn2)cc1
Show InChI InChI=1S/C33H51N2O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-33(36)35-31(28-41-42(37,38)39)26-29-21-23-32(24-22-29)40-27-30-19-17-18-25-34-30/h9-10,17-19,21-25,31H,2-8,11-16,20,26-28H2,1H3,(H,35,36)(H2,37,38,39)/b10-9-/t31-/m0/s1
Affinity DataKi:  940nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
TargetLysophosphatidic acid receptor 3(Homo sapiens (Human))
University of Tennessee Health Science Center

Curated by ChEMBL
LigandPNGBDBM50150004(CHEMBL360064 | {(S)-3-Hexadecanoylamino-4-[4-(pyri...)
Show SMILES CCCCCCCCCCCCCCCC(=O)N[C@H](CCP(O)(O)=O)Cc1ccc(OCc2ccccn2)cc1
Show InChI InChI=1S/C32H51N2O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-32(35)34-29(23-25-40(36,37)38)26-28-19-21-31(22-20-28)39-27-30-17-15-16-24-33-30/h15-17,19-22,24,29H,2-14,18,23,25-27H2,1H3,(H,34,35)(H2,36,37,38)/t29-/m1/s1
Affinity DataKi:  1.05E+3nMAssay Description:Binding affinity towards Lysophosphatidic acid 3 (LPA3) receptorMore data for this Ligand-Target Pair
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