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Compile Data Set for Download or QSAR

Found 114 hits of ec50 data for polymerid = 6553   
Target
(Institution)
LigandTarget
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
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031386
PNG
((S)-2-{(S)-2-[(S)-2-[(S)-2-((S)-2-Amino-propionyla...)
Show SMILES COc1c(I)cc(C[C@H](NC(=O)[C@H](Cc2ccc(Cl)c(Cl)c2)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC2CCCCC2)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O)cc1I
Show InChI InChI=1S/C37H51Cl2I2N9O6/c1-19(42)33(52)48-29(17-21-10-11-23(38)24(39)13-21)35(54)50-30(18-22-14-25(40)31(56-2)26(41)15-22)36(55)49-28(16-20-7-4-3-5-8-20)34(53)47-27(32(43)51)9-6-12-46-37(44)45/h10-11,13-15,19-20,27-30H,3-9,12,16-18,42H2,1-2H3,(H2,43,51)(H,47,53)(H,48,52)(H,49,55)(H,50,54)(H4,44,45,46)/t19-,27-,28-,29-,30-/m0/s1
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n/an/an/an/a 10n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031422
PNG
((S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-propionyla...)
Show SMILES C[C@H](N)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CCCCNC(N)=N)C(=O)NC(Cc1ccc(O)c(I)c1)C(N)=O
Show InChI InChI=1S/C43H65FIN13O7/c1-24(46)37(61)57-33(22-26-12-15-28(44)16-13-26)40(64)55-31(11-7-19-53-43(50)51)39(63)58-34(21-25-8-3-2-4-9-25)41(65)54-30(10-5-6-18-52-42(48)49)38(62)56-32(36(47)60)23-27-14-17-35(59)29(45)20-27/h12-17,20,24-25,30-34,59H,2-11,18-19,21-23,46H2,1H3,(H2,47,60)(H,54,65)(H,55,64)(H,56,62)(H,57,61)(H,58,63)(H4,48,49,52)(H4,50,51,53)/t24-,30-,31-,32?,33-,34-/m0/s1
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n/an/an/an/a 30n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activity of Radio-ligand Peptides upon the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50054858
PNG
(CHEMBL144504 | Thiophene-2-carboxylic acid [1-[1-[...)
Show SMILES CC(C)CC(NC(=O)C(Cc1ccc(cc1)N=C(N)N)NC(=O)C(Cc1ccc(F)cc1)NC(=O)c1cccs1)C(=O)NC(CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C36H48FN11O5S/c1-20(2)17-26(31(50)45-25(30(38)49)5-3-15-43-35(39)40)46-32(51)27(19-22-9-13-24(14-10-22)44-36(41)42)47-33(52)28(18-21-7-11-23(37)12-8-21)48-34(53)29-6-4-16-54-29/h4,6-14,16,20,25-28H,3,5,15,17-19H2,1-2H3,(H2,38,49)(H,45,50)(H,46,51)(H,47,52)(H,48,53)(H4,39,40,43)(H4,41,42,44)
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Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit agonist (SFFLRR-NH2, at 3 uM) induced platelet aggregation by 50%


J Med Chem 39: 4879-87 (1997)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031382
PNG
((S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-propionyla...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C31H52FN9O5/c1-17(2)14-23(28(44)38-22(26(34)42)8-6-7-13-37-31(35)36)40-29(45)24(15-18(3)4)41-30(46)25(39-27(43)19(5)33)16-20-9-11-21(32)12-10-20/h9-12,17-19,22-25H,6-8,13-16,33H2,1-5H3,(H2,34,42)(H,38,44)(H,39,43)(H,40,45)(H,41,46)(H4,35,36,37)/t19-,22-,23-,24-,25-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031432
PNG
((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-propionylamino)-3...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C30H51FN12O5/c1-16(2)14-22(27(47)40-20(24(33)44)6-4-12-38-29(34)35)43-26(46)21(7-5-13-39-30(36)37)41-28(48)23(42-25(45)17(3)32)15-18-8-10-19(31)11-9-18/h8-11,16-17,20-23H,4-7,12-15,32H2,1-3H3,(H2,33,44)(H,40,47)(H,41,48)(H,42,45)(H,43,46)(H4,34,35,38)(H4,36,37,39)/t17-,20-,21-,22-,23-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031427
PNG
((S)-2-[(S)-2-((S)-2-Amino-propionylamino)-3-(4-flu...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C33H54FN9O5/c1-19(2)16-25(42-32(48)26(41-29(45)20(3)35)18-22-11-13-23(34)14-12-22)30(46)43-27(17-21-8-5-4-6-9-21)31(47)40-24(28(36)44)10-7-15-39-33(37)38/h11-14,19-21,24-27H,4-10,15-18,35H2,1-3H3,(H2,36,44)(H,40,47)(H,41,45)(H,42,48)(H,43,46)(H4,37,38,39)/t20-,24-,25-,26-,27-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031380
PNG
((S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-propionyla...)
Show SMILES C[C@H](N)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CCCCNC(N)=N)C(=O)NC(Cc1cc(I)c(O)c(I)c1)C(N)=O
Show InChI InChI=1S/C43H64FI2N13O7/c1-23(47)37(62)58-33(21-25-12-14-27(44)15-13-25)40(65)56-31(11-7-17-54-43(51)52)39(64)59-34(20-24-8-3-2-4-9-24)41(66)55-30(10-5-6-16-53-42(49)50)38(63)57-32(36(48)61)22-26-18-28(45)35(60)29(46)19-26/h12-15,18-19,23-24,30-34,60H,2-11,16-17,20-22,47H2,1H3,(H2,48,61)(H,55,66)(H,56,65)(H,57,63)(H,58,62)(H,59,64)(H4,49,50,53)(H4,51,52,54)/t23-,30-,31-,32?,33-,34-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activity of Radio-ligand Peptides upon the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031406
PNG
((S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-propionyla...)
Show SMILES C[C@H](N)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CCCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C43H66FN13O7/c1-25(45)37(60)56-34(24-27-12-16-29(44)17-13-27)40(63)54-32(11-7-21-52-43(49)50)39(62)57-35(23-26-8-3-2-4-9-26)41(64)53-31(10-5-6-20-51-42(47)48)38(61)55-33(36(46)59)22-28-14-18-30(58)19-15-28/h12-19,25-26,31-35,58H,2-11,20-24,45H2,1H3,(H2,46,59)(H,53,64)(H,54,63)(H,55,61)(H,56,60)(H,57,62)(H4,47,48,51)(H4,49,50,52)/t25-,31-,32-,33-,34-,35-/m0/s1
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n/an/an/an/a 160n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031406
PNG
((S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-propionyla...)
Show SMILES C[C@H](N)C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CCCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O
Show InChI InChI=1S/C43H66FN13O7/c1-25(45)37(60)56-34(24-27-12-16-29(44)17-13-27)40(63)54-32(11-7-21-52-43(49)50)39(62)57-35(23-26-8-3-2-4-9-26)41(64)53-31(10-5-6-20-51-42(47)48)38(61)55-33(36(46)59)22-28-14-18-30(58)19-15-28/h12-19,25-26,31-35,58H,2-11,20-24,45H2,1H3,(H2,46,59)(H,53,64)(H,54,63)(H,55,61)(H,56,60)(H,57,62)(H4,47,48,51)(H4,49,50,52)/t25-,31-,32-,33-,34-,35-/m0/s1
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n/an/an/an/a 160n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50440859
PNG
(CHEMBL2431718)
Show SMILES CCCCCCCCCCCCCCCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C100H178N30O26S/c1-10-11-12-13-14-15-16-17-18-19-20-21-25-40-78(137)115-62(37-30-43-110-98(104)105)82(140)129-76(55-157)95(153)122-68(47-57(4)5)88(146)126-74(53-134)93(151)128-75(54-135)94(152)127-71(50-131)90(148)113-60(9)81(139)130-79(58(6)7)96(154)114-59(8)80(138)120-69(49-77(103)136)89(147)117-66(39-32-45-112-100(108)109)86(144)125-72(51-132)91(149)118-63(35-26-28-41-101)83(141)116-64(36-27-29-42-102)85(143)124-73(52-133)92(150)119-65(38-31-44-111-99(106)107)84(142)121-67(46-56(2)3)87(145)123-70(97(155)156)48-61-33-23-22-24-34-61/h22-24,33-34,56-60,62-76,79,131-135,157H,10-21,25-32,35-55,101-102H2,1-9H3,(H2,103,136)(H,113,148)(H,114,154)(H,115,137)(H,116,141)(H,117,147)(H,118,149)(H,119,150)(H,120,138)(H,121,142)(H,122,153)(H,123,145)(H,124,143)(H,125,144)(H,126,146)(H,127,152)(H,128,151)(H,129,140)(H,130,139)(H,155,156)(H4,104,105,110)(H4,106,107,111)(H4,108,109,112)/t59-,60-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,79-/m0/s1
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n/an/an/an/a 180n/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Agonist activity at human PAR1 expressed in African green monkey COS7 cells assessed as stimulation of inositol triphosphate production


J Med Chem 56: 7477-97 (2013)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031413
PNG
((S)-2-[(S)-2-((S)-2-Amino-propionylamino)-3-(4-flu...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C30H50FN9O5/c1-16(2)13-22(27(43)37-21(25(33)41)7-6-12-36-30(34)35)39-28(44)23(14-17(3)4)40-29(45)24(38-26(42)18(5)32)15-19-8-10-20(31)11-9-19/h8-11,16-18,21-24H,6-7,12-15,32H2,1-5H3,(H2,33,41)(H,37,43)(H,38,42)(H,39,44)(H,40,45)(H4,34,35,36)/t18-,21-,22-,23-,24-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031392
PNG
((S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-3-h...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C34H57N11O8/c1-18(2)13-24(31(51)41-22(11-8-12-40-34(38)39)30(50)42-23(28(37)48)16-27(36)47)44-32(52)25(14-19(3)4)45-33(53)26(43-29(49)21(35)17-46)15-20-9-6-5-7-10-20/h5-7,9-10,18-19,21-26,46H,8,11-17,35H2,1-4H3,(H2,36,47)(H2,37,48)(H,41,51)(H,42,50)(H,43,49)(H,44,52)(H,45,53)(H4,38,39,40)/t21-,22-,23-,24-,25-,26-/m0/s1
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n/an/an/an/a 200n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031398
PNG
((S)-2-[(S)-2-((S)-2-Amino-propionylamino)-3-(3,4-d...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C33H53Cl2N9O5/c1-18(2)14-25(43-32(49)27(42-29(46)19(3)36)17-21-11-12-22(34)23(35)15-21)30(47)44-26(16-20-8-5-4-6-9-20)31(48)41-24(28(37)45)10-7-13-40-33(38)39/h11-12,15,18-20,24-27H,4-10,13-14,16-17,36H2,1-3H3,(H2,37,45)(H,41,48)(H,42,46)(H,43,49)(H,44,47)(H4,38,39,40)/t19-,24-,25-,26-,27-/m0/s1
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n/an/an/an/a 270n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50054859
PNG
(2-{(R)-2-[2-(3-Acetylamino-propionylamino)-3-(4-fl...)
Show SMILES CC(C)CC(NC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)C(Cc1ccc(F)cc1)NC(=O)CCNC(C)=O)C(=O)NC(CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C39H52FN9O6/c1-23(2)19-31(36(53)47-30(35(41)52)9-6-17-45-39(42)43)48-38(55)33(22-26-10-13-27-7-4-5-8-28(27)20-26)49-37(54)32(21-25-11-14-29(40)15-12-25)46-34(51)16-18-44-24(3)50/h4-5,7-8,10-15,20,23,30-33H,6,9,16-19,21-22H2,1-3H3,(H2,41,52)(H,44,50)(H,46,51)(H,47,53)(H,48,55)(H,49,54)(H4,42,43,45)/t30?,31?,32?,33-/m1/s1
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n/an/an/an/a 270n/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Effective concentration for stimulation of platelet aggregation


J Med Chem 39: 4879-87 (1997)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031392
PNG
((S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-3-h...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C34H57N11O8/c1-18(2)13-24(31(51)41-22(11-8-12-40-34(38)39)30(50)42-23(28(37)48)16-27(36)47)44-32(52)25(14-19(3)4)45-33(53)26(43-29(49)21(35)17-46)15-20-9-6-5-7-10-20/h5-7,9-10,18-19,21-26,46H,8,11-17,35H2,1-4H3,(H2,36,47)(H2,37,48)(H,41,51)(H,42,50)(H,43,49)(H,44,52)(H,45,53)(H4,38,39,40)/t21-,22-,23-,24-,25-,26-/m0/s1
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n/an/an/an/a 280n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031398
PNG
((S)-2-[(S)-2-((S)-2-Amino-propionylamino)-3-(3,4-d...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C33H53Cl2N9O5/c1-18(2)14-25(43-32(49)27(42-29(46)19(3)36)17-21-11-12-22(34)23(35)15-21)30(47)44-26(16-20-8-5-4-6-9-20)31(48)41-24(28(37)45)10-7-13-40-33(38)39/h11-12,15,18-20,24-27H,4-10,13-14,16-17,36H2,1-3H3,(H2,37,45)(H,41,48)(H,42,46)(H,43,49)(H,44,47)(H4,38,39,40)/t19-,24-,25-,26-,27-/m0/s1
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n/an/an/an/a 300n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activity of Radio-ligand Peptides upon the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031424
PNG
((S)-2-[(S)-2-((S)-2-Amino-propionylamino)-3-phenyl...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C33H55N9O5/c1-20(2)17-25(41-32(47)26(40-29(44)21(3)34)18-22-11-6-4-7-12-22)30(45)42-27(19-23-13-8-5-9-14-23)31(46)39-24(28(35)43)15-10-16-38-33(36)37/h4,6-7,11-12,20-21,23-27H,5,8-10,13-19,34H2,1-3H3,(H2,35,43)(H,39,46)(H,40,44)(H,41,47)(H,42,45)(H4,36,37,38)/t21-,24-,25-,26-,27-/m0/s1
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n/an/an/an/a 400n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077726
PNG
(5-Bromo-N-{(S)-1-[(S)-1-((S)-1-carbamoyl-2-phenyl-...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1cncc(Br)c1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C30H41BrN8O4/c31-22-16-21(17-35-18-22)27(41)39-25(15-20-10-5-2-6-11-20)29(43)37-23(12-7-13-36-30(33)34)28(42)38-24(26(32)40)14-19-8-3-1-4-9-19/h1,3-4,8-9,16-18,20,23-25H,2,5-7,10-15H2,(H2,32,40)(H,37,43)(H,38,42)(H,39,41)(H4,33,34,36)/t23-,24-,25-/m0/s1
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n/an/an/an/a 460n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031397
PNG
((S)-2-[(S)-2-((S)-2-Amino-propionylamino)-3-(3,4-d...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C30H49Cl2N9O5/c1-15(2)11-22(27(44)38-21(25(34)42)7-6-10-37-30(35)36)40-28(45)23(12-16(3)4)41-29(46)24(39-26(43)17(5)33)14-18-8-9-19(31)20(32)13-18/h8-9,13,15-17,21-24H,6-7,10-12,14,33H2,1-5H3,(H2,34,42)(H,38,44)(H,39,43)(H,40,45)(H,41,46)(H4,35,36,37)/t17-,21-,22-,23-,24-/m0/s1
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n/an/an/an/a 500n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031414
PNG
(1-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(N)=O
Show InChI InChI=1S/C39H64N12O9/c1-21(2)16-26(48-36(58)27(17-22(3)4)49-37(59)28(47-33(55)24(40)20-52)18-23-10-6-5-7-11-23)35(57)46-25(12-8-14-45-39(43)44)34(56)50-29(19-31(41)53)38(60)51-15-9-13-30(51)32(42)54/h5-7,10-11,21-22,24-30,52H,8-9,12-20,40H2,1-4H3,(H2,41,53)(H2,42,54)(H,46,57)(H,47,55)(H,48,58)(H,49,59)(H,50,56)(H4,43,44,45)/t24-,25-,26-,27-,28-,29-,30-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077747
PNG
(4-Oxo-4H-chromene-2-carboxylic acid {(S)-1-[(S)-1-...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1cc(=O)c2ccccc2o1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C34H43N7O6/c35-30(43)25(18-21-10-3-1-4-11-21)40-31(44)24(15-9-17-38-34(36)37)39-32(45)26(19-22-12-5-2-6-13-22)41-33(46)29-20-27(42)23-14-7-8-16-28(23)47-29/h1,3-4,7-8,10-11,14,16,20,22,24-26H,2,5-6,9,12-13,15,17-19H2,(H2,35,43)(H,39,45)(H,40,44)(H,41,46)(H4,36,37,38)/t24-,25-,26-/m0/s1
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The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031407
PNG
((S)-2-[(S)-2-((S)-2-Amino-propionylamino)-3-(4-chl...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C30H50ClN9O5/c1-16(2)13-22(27(43)37-21(25(33)41)7-6-12-36-30(34)35)39-28(44)23(14-17(3)4)40-29(45)24(38-26(42)18(5)32)15-19-8-10-20(31)11-9-19/h8-11,16-18,21-24H,6-7,12-15,32H2,1-5H3,(H2,33,41)(H,37,43)(H,38,42)(H,39,44)(H,40,45)(H4,34,35,36)/t18-,21-,22-,23-,24-/m0/s1
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n/an/an/an/a 700n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50454438
PNG
(CHEMBL2370948)
Show SMILES COc1ccc(C[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O)cc1
Show InChI InChI=1S/C31H53N9O7/c1-17(2)13-23(28(44)37-22(26(33)42)7-6-12-36-31(34)35)39-29(45)24(14-18(3)4)40-30(46)25(38-27(43)21(32)16-41)15-19-8-10-20(47-5)11-9-19/h8-11,17-18,21-25,41H,6-7,12-16,32H2,1-5H3,(H2,33,42)(H,37,44)(H,38,43)(H,39,45)(H,40,46)(H4,34,35,36)/t21-,22-,23-,24-,25-/m0/s1
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n/an/an/an/a 720n/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Effective concentration for stimulation of platelet aggregation


J Med Chem 39: 4879-87 (1997)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077752
PNG
(5-((E)-2-Methyl-3-phenyl-acryloylamino)-1H-[1,2,4]...)
Show SMILES CC(=Cc1ccccc1)C(=O)Nc1nnc([nH]1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C37H49N11O5/c1-23(20-24-12-5-2-6-13-24)32(50)46-37-45-31(47-48-37)35(53)44-29(22-26-16-9-4-10-17-26)34(52)42-27(18-11-19-41-36(39)40)33(51)43-28(30(38)49)21-25-14-7-3-8-15-25/h2-3,5-8,12-15,20,26-29H,4,9-11,16-19,21-22H2,1H3,(H2,38,49)(H,42,52)(H,43,51)(H,44,53)(H4,39,40,41)(H2,45,46,47,48,50)/t27-,28-,29-/m0/s1
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n/an/an/an/a 760n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077748
PNG
(5-Amino-1H-[1,2,4]triazole-3-carboxylic acid {(S)-...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1nnc(N)[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C27H41N11O4/c28-21(39)19(14-16-8-3-1-4-9-16)34-23(40)18(12-7-13-32-26(29)30)33-24(41)20(15-17-10-5-2-6-11-17)35-25(42)22-36-27(31)38-37-22/h1,3-4,8-9,17-20H,2,5-7,10-15H2,(H2,28,39)(H,33,41)(H,34,40)(H,35,42)(H4,29,30,32)(H3,31,36,37,38)/t18-,19-,20-/m0/s1
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n/an/an/an/a 760n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031417
PNG
((S)-2-[(S)-2-((S)-2-Amino-propionylamino)-3-phenyl...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C30H51N9O5/c1-17(2)14-22(27(42)36-21(25(32)40)12-9-13-35-30(33)34)38-28(43)23(15-18(3)4)39-29(44)24(37-26(41)19(5)31)16-20-10-7-6-8-11-20/h6-8,10-11,17-19,21-24H,9,12-16,31H2,1-5H3,(H2,32,40)(H,36,42)(H,37,41)(H,38,43)(H,39,44)(H4,33,34,35)/t19-,21-,22-,23-,24-/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077743
PNG
(CHEMBL33532 | Quinoxaline-2-carboxylic acid {(S)-1...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1cnc2ccccc2n1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C33H43N9O4/c34-29(43)26(18-21-10-3-1-4-11-21)41-30(44)25(16-9-17-37-33(35)36)40-31(45)27(19-22-12-5-2-6-13-22)42-32(46)28-20-38-23-14-7-8-15-24(23)39-28/h1,3-4,7-8,10-11,14-15,20,22,25-27H,2,5-6,9,12-13,16-19H2,(H2,34,43)(H,40,45)(H,41,44)(H,42,46)(H4,35,36,37)/t25-,26-,27-/m0/s1
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n/an/an/an/a 1.00E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077738
PNG
(5-((E)-3-Naphthalen-1-yl-acryloylamino)-1H-[1,2,4]...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1nnc(NC(=O)C=Cc2cccc3ccccc23)[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C40H49N11O5/c41-34(53)31(23-25-11-3-1-4-12-25)46-36(54)30(19-10-22-44-39(42)43)45-37(55)32(24-26-13-5-2-6-14-26)47-38(56)35-49-40(51-50-35)48-33(52)21-20-28-17-9-16-27-15-7-8-18-29(27)28/h1,3-4,7-9,11-12,15-18,20-21,26,30-32H,2,5-6,10,13-14,19,22-24H2,(H2,41,53)(H,45,55)(H,46,54)(H,47,56)(H4,42,43,44)(H2,48,49,50,51,52)/t30-,31-,32-/m0/s1
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n/an/an/an/a 1.00E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031381
PNG
((S)-2-[(S)-2-((S)-2-Amino-3-hydroxy-propionylamino...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C30H51N9O6/c1-17(2)13-22(27(43)36-21(25(32)41)11-8-12-35-30(33)34)38-28(44)23(14-18(3)4)39-29(45)24(37-26(42)20(31)16-40)15-19-9-6-5-7-10-19/h5-7,9-10,17-18,20-24,40H,8,11-16,31H2,1-4H3,(H2,32,41)(H,36,43)(H,37,42)(H,38,44)(H,39,45)(H4,33,34,35)/t20-,21-,22-,23-,24-/m0/s1
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n/an/an/an/a 1.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077744
PNG
(5-Amino-1H-[1,2,4]triazole-3-carboxylic acid {(S)-...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1nnc(N)[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C27H35N11O4/c28-21(39)19(14-16-8-3-1-4-9-16)34-23(40)18(12-7-13-32-26(29)30)33-24(41)20(15-17-10-5-2-6-11-17)35-25(42)22-36-27(31)38-37-22/h1-6,8-11,18-20H,7,12-15H2,(H2,28,39)(H,33,41)(H,34,40)(H,35,42)(H4,29,30,32)(H3,31,36,37,38)/t18-,19-,20-/m0/s1
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n/an/an/an/a 1.00E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077741
PNG
(5-[(E)-3-(2-Chloro-phenyl)-acryloylamino]-1H-[1,2,...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1nnc(NC(=O)C=Cc2ccccc2Cl)[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C36H46ClN11O5/c37-25-15-8-7-14-24(25)17-18-29(49)45-36-46-31(47-48-36)34(53)44-28(21-23-12-5-2-6-13-23)33(52)42-26(16-9-19-41-35(39)40)32(51)43-27(30(38)50)20-22-10-3-1-4-11-22/h1,3-4,7-8,10-11,14-15,17-18,23,26-28H,2,5-6,9,12-13,16,19-21H2,(H2,38,50)(H,42,52)(H,43,51)(H,44,53)(H4,39,40,41)(H2,45,46,47,48,49)/t26-,27-,28-/m0/s1
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n/an/an/an/a 1.10E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077728
PNG
(Biphenylene-2-carboxylic acid {(S)-1-[(S)-1-((S)-1...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1ccc2-c3ccccc3-c2c1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C37H45N7O4/c38-33(45)31(20-23-10-3-1-4-11-23)43-35(47)30(16-9-19-41-37(39)40)42-36(48)32(21-24-12-5-2-6-13-24)44-34(46)25-17-18-28-26-14-7-8-15-27(26)29(28)22-25/h1,3-4,7-8,10-11,14-15,17-18,22,24,30-32H,2,5-6,9,12-13,16,19-21H2,(H2,38,45)(H,42,48)(H,43,47)(H,44,46)(H4,39,40,41)/t30-,31-,32-/m0/s1
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n/an/an/an/a 1.20E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031401
PNG
((S)-2-[(S)-2-(2-Amino-acetylamino)-3-phenyl-propio...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C29H49N9O5/c1-17(2)13-21(26(41)36-20(25(31)40)11-8-12-34-29(32)33)37-27(42)22(14-18(3)4)38-28(43)23(35-24(39)16-30)15-19-9-6-5-7-10-19/h5-7,9-10,17-18,20-23H,8,11-16,30H2,1-4H3,(H2,31,40)(H,35,39)(H,36,41)(H,37,42)(H,38,43)(H4,32,33,34)/t20-,21-,22-,23-/m0/s1
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n/an/an/an/a 1.20E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077750
PNG
(6-Amino-N-{(S)-1-[(S)-1-((S)-1-carbamoyl-2-phenyl-...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1ccc(N)nc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C30H43N9O4/c31-25-14-13-21(18-36-25)27(41)39-24(17-20-10-5-2-6-11-20)29(43)37-22(12-7-15-35-30(33)34)28(42)38-23(26(32)40)16-19-8-3-1-4-9-19/h1,3-4,8-9,13-14,18,20,22-24H,2,5-7,10-12,15-17H2,(H2,31,36)(H2,32,40)(H,37,43)(H,38,42)(H,39,41)(H4,33,34,35)/t22-,23-,24-/m0/s1
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n/an/an/an/a 1.20E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031405
PNG
((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-3-hydroxy-propion...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C27H45N9O6/c1-15(2)12-20(26(42)34-19(22(29)38)10-7-11-32-27(30)31)35-23(39)16(3)33-25(41)21(36-24(40)18(28)14-37)13-17-8-5-4-6-9-17/h4-6,8-9,15-16,18-21,37H,7,10-14,28H2,1-3H3,(H2,29,38)(H,33,41)(H,34,42)(H,35,39)(H,36,40)(H4,30,31,32)/t16-,18-,19-,20-,21-/m0/s1
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n/an/an/an/a 1.30E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077732
PNG
(CHEMBL285018 | [1,2,3]Thiadiazole-4-carboxylic aci...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1csnn1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C27H39N9O4S/c28-23(37)20(14-17-8-3-1-4-9-17)33-24(38)19(12-7-13-31-27(29)30)32-25(39)21(15-18-10-5-2-6-11-18)34-26(40)22-16-41-36-35-22/h1,3-4,8-9,16,18-21H,2,5-7,10-15H2,(H2,28,37)(H,32,39)(H,33,38)(H,34,40)(H4,29,30,31)/t19-,20-,21-/m0/s1
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n/an/an/an/a 1.30E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031386
PNG
((S)-2-{(S)-2-[(S)-2-[(S)-2-((S)-2-Amino-propionyla...)
Show SMILES COc1c(I)cc(C[C@H](NC(=O)[C@H](Cc2ccc(Cl)c(Cl)c2)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC2CCCCC2)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O)cc1I
Show InChI InChI=1S/C37H51Cl2I2N9O6/c1-19(42)33(52)48-29(17-21-10-11-23(38)24(39)13-21)35(54)50-30(18-22-14-25(40)31(56-2)26(41)15-22)36(55)49-28(16-20-7-4-3-5-8-20)34(53)47-27(32(43)51)9-6-12-46-37(44)45/h10-11,13-15,19-20,27-30H,3-9,12,16-18,42H2,1-2H3,(H2,43,51)(H,47,53)(H,48,52)(H,49,55)(H,50,54)(H4,44,45,46)/t19-,27-,28-,29-,30-/m0/s1
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n/an/an/an/a 1.50E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activity of Radio-ligand Peptides upon the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077749
PNG
(5-((Z)-2-Fluoro-3-phenyl-acryloylamino)-1H-[1,2,4]...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1nnc(NC(=O)C(F)=Cc2ccccc2)[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C36H46FN11O5/c37-25(19-22-11-4-1-5-12-22)31(50)46-36-45-30(47-48-36)34(53)44-28(21-24-15-8-3-9-16-24)33(52)42-26(17-10-18-41-35(39)40)32(51)43-27(29(38)49)20-23-13-6-2-7-14-23/h1-2,4-7,11-14,19,24,26-28H,3,8-10,15-18,20-21H2,(H2,38,49)(H,42,52)(H,43,51)(H,44,53)(H4,39,40,41)(H2,45,46,47,48,50)/t26-,27-,28-/m0/s1
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n/an/an/an/a 1.70E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50054870
PNG
(1H-Indole-2-carboxylic acid [1-[1-[1-(1-carbamoyl-...)
Show SMILES CC(C)CC(NC(=O)C(Cc1ccc(cc1)N=C(N)N)NC(=O)C(Cc1ccc(F)cc1)NC(=O)c1cc2ccccc2[nH]1)C(=O)NC(CCCNC(N)=N)C(N)=O
Show InChI InChI=1S/C40H51FN12O5/c1-22(2)18-30(35(55)50-29(34(42)54)8-5-17-47-39(43)44)51-36(56)32(20-24-11-15-27(16-12-24)48-40(45)46)52-37(57)31(19-23-9-13-26(41)14-10-23)53-38(58)33-21-25-6-3-4-7-28(25)49-33/h3-4,6-7,9-16,21-22,29-32,49H,5,8,17-20H2,1-2H3,(H2,42,54)(H,50,55)(H,51,56)(H,52,57)(H,53,58)(H4,43,44,47)(H4,45,46,48)
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n/an/an/an/a 1.80E+3n/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Effective concentration for stimulation of platelet aggregation


J Med Chem 39: 4879-87 (1997)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077740
PNG
(5-[(E)-3-(3-Nitro-phenyl)-acryloylamino]-1H-[1,2,4...)
Show SMILES NC([NH-])=[NH+]CCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1nnc(NC(=O)C=Cc2cccc(c2)[N+]([O-])=O)[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C36H46N12O7/c37-30(50)27(20-22-9-3-1-4-10-22)42-32(51)26(15-8-18-40-35(38)39)41-33(52)28(21-23-11-5-2-6-12-23)43-34(53)31-45-36(47-46-31)44-29(49)17-16-24-13-7-14-25(19-24)48(54)55/h1,3-4,7,9-10,13-14,16-17,19,23,26-28H,2,5-6,8,11-12,15,18,20-21H2,(H11,37,38,39,40,41,42,43,44,45,46,47,49,50,51,52,53)/t26-,27-,28-/m0/s1
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n/an/an/an/a 1.90E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077751
PNG
(5-[(E)-3-(2-Nitro-phenyl)-acryloylamino]-1H-[1,2,4...)
Show SMILES NC([NH-])=[NH+]CCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1nnc(NC(=O)C=Cc2ccccc2[N+]([O-])=O)[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C36H46N12O7/c37-30(50)26(20-22-10-3-1-4-11-22)42-32(51)25(15-9-19-40-35(38)39)41-33(52)27(21-23-12-5-2-6-13-23)43-34(53)31-45-36(47-46-31)44-29(49)18-17-24-14-7-8-16-28(24)48(54)55/h1,3-4,7-8,10-11,14,16-18,23,25-27H,2,5-6,9,12-13,15,19-21H2,(H11,37,38,39,40,41,42,43,44,45,46,47,49,50,51,52,53)/t25-,26-,27-/m0/s1
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n/an/an/an/a 1.90E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031420
PNG
(CHEMBL263369 | SFLLRDPQDK-NH2)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCCN)C(N)=O
Show InChI InChI=1S/C53H87N17O15/c1-27(2)20-33(65-47(80)34(21-28(3)4)66-48(81)35(64-44(77)30(55)26-71)22-29-12-6-5-7-13-29)46(79)63-32(15-10-18-61-53(59)60)45(78)69-38(24-41(57)73)52(85)70-19-11-16-39(70)51(84)68-36(23-40(56)72)49(82)67-37(25-42(74)75)50(83)62-31(43(58)76)14-8-9-17-54/h5-7,12-13,27-28,30-39,71H,8-11,14-26,54-55H2,1-4H3,(H2,56,72)(H2,57,73)(H2,58,76)(H,62,83)(H,63,79)(H,64,77)(H,65,80)(H,66,81)(H,67,82)(H,68,84)(H,69,78)(H,74,75)(H4,59,60,61)/t30-,31-,32-,33-,34-,35-,36-,37-,38-,39-/m0/s1
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n/an/an/an/a 2.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077730
PNG
(CHEMBL284498 | N-{(S)-1-[(S)-1-((S)-1-Carbamoyl-2-...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1cccnc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C30H42N8O4/c31-26(39)24(17-20-9-3-1-4-10-20)37-28(41)23(14-8-16-35-30(32)33)36-29(42)25(18-21-11-5-2-6-12-21)38-27(40)22-13-7-15-34-19-22/h1,3-4,7,9-10,13,15,19,21,23-25H,2,5-6,8,11-12,14,16-18H2,(H2,31,39)(H,36,42)(H,37,41)(H,38,40)(H4,32,33,35)/t23-,24-,25-/m0/s1
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n/an/an/an/a 2.00E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077746
PNG
(5-Amino-1H-[1,2,4]triazole-3-carboxylic acid {(S)-...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1nnc(N)[nH]1)C(=O)N[C@@H](CC1CCCCC1)C(N)=O
Show InChI InChI=1S/C27H47N11O4/c28-21(39)19(14-16-8-3-1-4-9-16)34-23(40)18(12-7-13-32-26(29)30)33-24(41)20(15-17-10-5-2-6-11-17)35-25(42)22-36-27(31)38-37-22/h16-20H,1-15H2,(H2,28,39)(H,33,41)(H,34,40)(H,35,42)(H4,29,30,32)(H3,31,36,37,38)/t18-,19-,20-/m0/s1
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n/an/an/an/a 2.10E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077759
PNG
(5-[(E)-3-(3-Chloro-phenyl)-acryloylamino]-1H-[1,2,...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1nnc(NC(=O)C=Cc2cccc(Cl)c2)[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C36H46ClN11O5/c37-25-14-7-13-24(19-25)16-17-29(49)45-36-46-31(47-48-36)34(53)44-28(21-23-11-5-2-6-12-23)33(52)42-26(15-8-18-41-35(39)40)32(51)43-27(30(38)50)20-22-9-3-1-4-10-22/h1,3-4,7,9-10,13-14,16-17,19,23,26-28H,2,5-6,8,11-12,15,18,20-21H2,(H2,38,50)(H,42,52)(H,43,51)(H,44,53)(H4,39,40,41)(H2,45,46,47,48,49)/t26-,27-,28-/m0/s1
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n/an/an/an/a 2.40E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077754
PNG
((S)-2-[(S)-3-Cyclohexyl-2-((E)-3-pyridin-3-yl-acry...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)C=Cc1cccnc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C32H44N8O4/c33-29(42)26(19-22-9-3-1-4-10-22)40-30(43)25(14-8-18-37-32(34)35)39-31(44)27(20-23-11-5-2-6-12-23)38-28(41)16-15-24-13-7-17-36-21-24/h1,3-4,7,9-10,13,15-17,21,23,25-27H,2,5-6,8,11-12,14,18-20H2,(H2,33,42)(H,38,41)(H,39,44)(H,40,43)(H4,34,35,37)/t25-,26-,27-/m0/s1
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n/an/an/an/a 2.60E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077764
PNG
(3-Amino-N-{(S)-1-[(S)-1-((S)-1-carbamoyl-2-phenyl-...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1cccc(N)c1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C31H44N8O4/c32-23-14-7-13-22(19-23)28(41)39-26(18-21-11-5-2-6-12-21)30(43)37-24(15-8-16-36-31(34)35)29(42)38-25(27(33)40)17-20-9-3-1-4-10-20/h1,3-4,7,9-10,13-14,19,21,24-26H,2,5-6,8,11-12,15-18,32H2,(H2,33,40)(H,37,43)(H,38,42)(H,39,41)(H4,34,35,36)/t24-,25-,26-/m0/s1
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n/an/an/an/a 2.90E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077763
PNG
(5-((E)-3-Thiophen-2-yl-acryloylamino)-1H-[1,2,4]tr...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1nnc(NC(=O)C=Cc2cccs2)[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C34H45N11O5S/c35-28(47)25(19-21-9-3-1-4-10-21)40-30(48)24(14-7-17-38-33(36)37)39-31(49)26(20-22-11-5-2-6-12-22)41-32(50)29-43-34(45-44-29)42-27(46)16-15-23-13-8-18-51-23/h1,3-4,8-10,13,15-16,18,22,24-26H,2,5-7,11-12,14,17,19-20H2,(H2,35,47)(H,39,49)(H,40,48)(H,41,50)(H4,36,37,38)(H2,42,43,44,45,46)/t24-,25-,26-/m0/s1
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n/an/an/an/a 2.90E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50077720
PNG
(5-Amino-1H-[1,2,4]triazole-3-carboxylic acid ((S)-...)
Show SMILES NC(=N)NCCC[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1nnc(N)[nH]1)C(=O)N[C@H](C(N)=O)c1ccccc1
Show InChI InChI=1S/C26H39N11O4/c27-20(38)19(16-10-5-2-6-11-16)34-22(39)17(12-7-13-31-25(28)29)32-23(40)18(14-15-8-3-1-4-9-15)33-24(41)21-35-26(30)37-36-21/h2,5-6,10-11,15,17-19H,1,3-4,7-9,12-14H2,(H2,27,38)(H,32,40)(H,33,41)(H,34,39)(H4,28,29,31)(H3,30,35,36,37)/t17-,18-,19-/m0/s1
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n/an/an/an/a 3.10E+3n/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Activation of human platelet aggregation (gel-filtered platelets) induced by alpha thrombin


Bioorg Med Chem Lett 9: 1423-8 (1999)

More data for this
Ligand-Target Pair
Proteinase-activated receptor 1 (PAR1)


(Homo sapiens (Human))
BDBM50031421
PNG
(CHEMBL264249 | SFLLRDPQD-NH2)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(N)=O
Show InChI InChI=1S/C47H75N15O14/c1-23(2)16-29(58-42(72)30(17-24(3)4)59-43(73)31(57-39(69)26(48)22-63)18-25-10-6-5-7-11-25)41(71)55-27(12-8-14-54-47(52)53)40(70)61-33(20-36(50)65)46(76)62-15-9-13-34(62)45(75)60-32(19-35(49)64)44(74)56-28(38(51)68)21-37(66)67/h5-7,10-11,23-24,26-34,63H,8-9,12-22,48H2,1-4H3,(H2,49,64)(H2,50,65)(H2,51,68)(H,55,71)(H,56,74)(H,57,69)(H,58,72)(H,59,73)(H,60,75)(H,61,70)(H,66,67)(H4,52,53,54)/t26-,27-,28-,29-,30-,31-,32-,33-,34-/m0/s1
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n/an/an/an/a 3.30E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for the activation of human thrombin receptor measured by platelet aggregation


J Med Chem 38: 4125-30 (1995)

More data for this
Ligand-Target Pair
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