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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%


Citation and Details
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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n/an/an/an/a 120n/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))
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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n/an/an/an/a 130n/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))
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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n/an/an/an/a 140n/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))
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


Citation and Details
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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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))
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


Citation and Details
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


Citation and Details
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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Article
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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


Citation and Details
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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PubMed
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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