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27 similar compounds to monomer 50047281

Compile data set for download or QSAR
Wt: 515.5
BDBM50456020
Wt: 482.6
BDBM50047289
Wt: 510.6
BDBM50047290
Wt: 548.6
BDBM50047292
Wt: 522.6
BDBM50047294
Wt: 454.5
BDBM50047296
Wt: 452.5
BDBM50047297
Wt: 440.5
BDBM50047298
Wt: 464.5
BDBM50047299
Wt: 502.6
BDBM50047300
Wt: 456.5
BDBM50047265
Wt: 508.6
BDBM50047266
Wt: 494.6
BDBM50047267
Wt: 551.6
BDBM50047268
Wt: 494.5
BDBM50047269
Displayed 1 to 15 (of 27 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 50456020,50047289,50047290,50047292,50047294,50047296,50047297,50047298,50047299,50047300,50047265,50047266,50047267,50047268,50047269   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50456020
PNG
(CHEMBL2368531)
Show SMILES [O-]C(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCN1CCCCC1
Show InChI InChI=1S/C29H39N3O5.Li/c33-26(34)13-10-20-8-2-3-9-21(20)18-22-24-11-12-25(37-24)27(22)29-31-23(19-36-29)28(35)30-14-4-7-17-32-15-5-1-6-16-32;/h2-3,8-9,19,22,24-25,27H,1,4-7,10-18H2,(H,30,35)(H,33,34);/q;+1/p-1
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n/an/an/a 22n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047266
PNG
(3-(2-{3-[4-(4-Cyclohexyl-butylcarbamoyl)-oxazol-2-...)
Show SMILES OC(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCC1CCCCC1
Show InChI InChI=1S/C30H40N2O5/c33-27(34)16-13-21-11-4-5-12-22(21)18-23-25-14-15-26(37-25)28(23)30-32-24(19-36-30)29(35)31-17-7-6-10-20-8-2-1-3-9-20/h4-5,11-12,19-20,23,25-26,28H,1-3,6-10,13-18H2,(H,31,35)(H,33,34)
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n/an/an/a 0.100n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated for the receptor binding studies with Thromboxane A2 receptor using [3H]-SQ 29548 as radioligand in human platelet membranes.


Bioorg Med Chem Lett 1: 461-464 (1991)


Article DOI: 10.1016/S0960-894X(01)81106-9
BindingDB Entry DOI: 10.7270/Q2319VSZ
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047266
PNG
(3-(2-{3-[4-(4-Cyclohexyl-butylcarbamoyl)-oxazol-2-...)
Show SMILES OC(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCC1CCCCC1
Show InChI InChI=1S/C30H40N2O5/c33-27(34)16-13-21-11-4-5-12-22(21)18-23-25-14-15-26(37-25)28(23)30-32-24(19-36-30)29(35)31-17-7-6-10-20-8-2-1-3-9-20/h4-5,11-12,19-20,23,25-26,28H,1-3,6-10,13-18H2,(H,31,35)(H,33,34)
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n/an/an/a 0.100n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047267
PNG
(2-{3-[2-(3-Hydroxy-propyl)-benzyl]-7-oxa-bicyclo[2...)
Show SMILES OCCCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCC1CCCCC1
Show InChI InChI=1S/C30H42N2O4/c33-18-8-14-22-12-4-5-13-23(22)19-24-26-15-16-27(36-26)28(24)30-32-25(20-35-30)29(34)31-17-7-6-11-21-9-2-1-3-10-21/h4-5,12-13,20-21,24,26-28,33H,1-3,6-11,14-19H2,(H,31,34)
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n/an/an/a 112n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047268
PNG
(3-(2-{3-[4-(4-Cyclohexylcarbamoyl-butylcarbamoyl)-...)
Show SMILES OC(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCC(=O)NC1CCCCC1
Show InChI InChI=1S/C31H41N3O6/c35-27(33-22-10-2-1-3-11-22)12-6-7-17-32-30(38)24-19-39-31(34-24)29-23(25-14-15-26(29)40-25)18-21-9-5-4-8-20(21)13-16-28(36)37/h4-5,8-9,19,22-23,25-26,29H,1-3,6-7,10-18H2,(H,32,38)(H,33,35)(H,36,37)
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n/an/an/a 22n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047269
PNG
(3-(2-{3-[4-(5,5,5-Trifluoro-pentylcarbamoyl)-oxazo...)
Show SMILES OC(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCC(F)(F)F
Show InChI InChI=1S/C25H29F3N2O5/c26-25(27,28)11-3-4-12-29-23(33)18-14-34-24(30-18)22-17(19-8-9-20(22)35-19)13-16-6-2-1-5-15(16)7-10-21(31)32/h1-2,5-6,14,17,19-20,22H,3-4,7-13H2,(H,29,33)(H,31,32)
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n/an/an/a 4.80n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047289
PNG
(3-(2-{3-[4-(5,5-Dimethyl-hexylcarbamoyl)-oxazol-2-...)
Show SMILES CC(C)(C)CCCCNC(=O)c1coc(n1)C1C2CCC(O2)C1Cc1ccccc1CCC(O)=O
Show InChI InChI=1S/C28H38N2O5/c1-28(2,3)14-6-7-15-29-26(33)21-17-34-27(30-21)25-20(22-11-12-23(25)35-22)16-19-9-5-4-8-18(19)10-13-24(31)32/h4-5,8-9,17,20,22-23,25H,6-7,10-16H2,1-3H3,(H,29,33)(H,31,32)
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n/an/an/a 0.600n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047296
PNG
(3-(2-{3-[4-(3,3-Dimethyl-butylcarbamoyl)-oxazol-2-...)
Show SMILES CC(C)(C)CCNC(=O)c1coc(n1)C1C2CCC(O2)C1Cc1ccccc1CCC(O)=O
Show InChI InChI=1S/C26H34N2O5/c1-26(2,3)12-13-27-24(31)19-15-32-25(28-19)23-18(20-9-10-21(23)33-20)14-17-7-5-4-6-16(17)8-11-22(29)30/h4-7,15,18,20-21,23H,8-14H2,1-3H3,(H,27,31)(H,29,30)
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n/an/an/a 2.90n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047290
PNG
(3-{2-[3-(4-Decylcarbamoyl-oxazol-2-yl)-7-oxa-bicyc...)
Show SMILES CCCCCCCCCCNC(=O)c1coc(n1)C1C2CCC(O2)C1Cc1ccccc1CCC(O)=O
Show InChI InChI=1S/C30H42N2O5/c1-2-3-4-5-6-7-8-11-18-31-29(35)24-20-36-30(32-24)28-23(25-15-16-26(28)37-25)19-22-13-10-9-12-21(22)14-17-27(33)34/h9-10,12-13,20,23,25-26,28H,2-8,11,14-19H2,1H3,(H,31,35)(H,33,34)
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n/an/an/a 5.80n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047292
PNG
(3-[2-(3-{4-[4-(4-Methylsulfanyl-phenyl)-butylcarba...)
Show SMILES CSc1ccc(CCCCNC(=O)c2coc(n2)C2C3CCC(O3)C2Cc2ccccc2CCC(O)=O)cc1
Show InChI InChI=1S/C31H36N2O5S/c1-39-23-12-9-20(10-13-23)6-4-5-17-32-30(36)25-19-37-31(33-25)29-24(26-14-15-27(29)38-26)18-22-8-3-2-7-21(22)11-16-28(34)35/h2-3,7-10,12-13,19,24,26-27,29H,4-6,11,14-18H2,1H3,(H,32,36)(H,34,35)
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n/an/an/a 2.90n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047298
PNG
(3-(2-{3-[4-(1,1-Dimethyl-propylcarbamoyl)-oxazol-2...)
Show SMILES CCC(C)(C)NC(=O)c1coc(n1)C1C2CCC(O2)C1Cc1ccccc1CCC(O)=O
Show InChI InChI=1S/C25H32N2O5/c1-4-25(2,3)27-23(30)18-14-31-24(26-18)22-17(19-10-11-20(22)32-19)13-16-8-6-5-7-15(16)9-12-21(28)29/h5-8,14,17,19-20,22H,4,9-13H2,1-3H3,(H,27,30)(H,28,29)
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n/an/an/a 0.800n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047294
PNG
(4-(2-{3-[4-(4-Cyclohexyl-butylcarbamoyl)-oxazol-2-...)
Show SMILES OC(=O)CCCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCC1CCCCC1
Show InChI InChI=1S/C31H42N2O5/c34-28(35)15-8-14-22-12-4-5-13-23(22)19-24-26-16-17-27(38-26)29(24)31-33-25(20-37-31)30(36)32-18-7-6-11-21-9-2-1-3-10-21/h4-5,12-13,20-21,24,26-27,29H,1-3,6-11,14-19H2,(H,32,36)(H,34,35)
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n/an/an/a 0.850n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047297
PNG
(3-{2-[3-(4-Cyclohexylcarbamoyl-oxazol-2-yl)-7-oxa-...)
Show SMILES OC(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C26H32N2O5/c29-23(30)13-10-16-6-4-5-7-17(16)14-19-21-11-12-22(33-21)24(19)26-28-20(15-32-26)25(31)27-18-8-2-1-3-9-18/h4-7,15,18-19,21-22,24H,1-3,8-14H2,(H,27,31)(H,29,30)
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n/an/an/a 4.5n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047299
PNG
(3-{2-[3-(4-Hept-6-ynylcarbamoyl-oxazol-2-yl)-7-oxa...)
Show SMILES OC(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCCC#C
Show InChI InChI=1S/C27H32N2O5/c1-2-3-4-5-8-15-28-26(32)21-17-33-27(29-21)25-20(22-12-13-23(25)34-22)16-19-10-7-6-9-18(19)11-14-24(30)31/h1,6-7,9-10,17,20,22-23,25H,3-5,8,11-16H2,(H,28,32)(H,30,31)
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n/an/an/a 4.70n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047300
PNG
(3-(2-{3-[4-(4-Phenyl-butylcarbamoyl)-oxazol-2-yl]-...)
Show SMILES OC(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCc1ccccc1
Show InChI InChI=1S/C30H34N2O5/c33-27(34)16-13-21-11-4-5-12-22(21)18-23-25-14-15-26(37-25)28(23)30-32-24(19-36-30)29(35)31-17-7-6-10-20-8-2-1-3-9-20/h1-5,8-9,11-12,19,23,25-26,28H,6-7,10,13-18H2,(H,31,35)(H,33,34)
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n/an/an/a 0.300n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047266
PNG
(3-(2-{3-[4-(4-Cyclohexyl-butylcarbamoyl)-oxazol-2-...)
Show SMILES OC(=O)CCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCC1CCCCC1
Show InChI InChI=1S/C30H40N2O5/c33-27(34)16-13-21-11-4-5-12-22(21)18-23-25-14-15-26(37-25)28(23)30-32-24(19-36-30)29(35)31-17-7-6-10-20-8-2-1-3-9-20/h4-5,11-12,19-20,23,25-26,28H,1-3,6-10,13-18H2,(H,31,35)(H,33,34)
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TBA

Curated by ChEMBL


Assay Description
Dissociation constant was determined from radioligand binding studies in human platelet membranes using Thromboxane A2 receptor radioligand [3H]-SQ 2...


Bioorg Med Chem Lett 2: 937-940 (1992)


Article DOI: 10.1016/S0960-894X(00)80592-2
BindingDB Entry DOI: 10.7270/Q20R9P9X
More data for this
Ligand-Target Pair
Prostanoid TP receptor


(Homo sapiens (Human))
BDBM50047265
PNG
(3-(2-{3-[4-(5-Hydroxy-pentylcarbamoyl)-oxazol-2-yl...)
Show SMILES OCCCCCNC(=O)c1coc(n1)C1C2CCC(O2)C1Cc1ccccc1CCC(O)=O
Show InChI InChI=1S/C25H32N2O6/c28-13-5-1-4-12-26-24(31)19-15-32-25(27-19)23-18(20-9-10-21(23)33-20)14-17-7-3-2-6-16(17)8-11-22(29)30/h2-3,6-7,15,18,20-21,23,28H,1,4-5,8-14H2,(H,26,31)(H,29,30)
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n/an/an/a 20n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


Article DOI: 10.1021/jm00062a013
BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair