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PubMed code 9216842

Compile data set for download or QSAR
Found 28 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
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
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369268
PNG
(CHEMBL1790519)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(C)=O)C1c2ccccc2CCc2ccccc12)C(=O)N(C)[C@H]([C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C53H69N7O10/c1-9-30(5)45(52(68)60(8)47(31(6)10-2)51(67)58-42(53(69)70)26-35-28-54-39-22-16-15-19-36(35)39)59-49(65)41(27-43(62)63)56-48(64)40(25-29(3)4)57-50(66)46(55-32(7)61)44-37-20-13-11-17-33(37)23-24-34-18-12-14-21-38(34)44/h11-22,28-31,40-42,44-47,54H,9-10,23-27H2,1-8H3,(H,55,61)(H,56,64)(H,57,66)(H,58,67)(H,59,65)(H,62,63)(H,69,70)/t30-,31+,40-,41+,42-,45-,46+,47+/m0/s1
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n/an/a 1n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50032181
PNG
(2-{1-[1-(2-carboxy-1-{1-[10,11-dihydro-5H-dibenzo[...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C1c2ccccc2CCc2ccccc12)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C52H67N7O10/c1-8-29(5)44(49(65)57-41(52(68)69)25-34-27-53-38-21-15-14-18-35(34)38)59-50(66)45(30(6)9-2)58-48(64)40(26-42(61)62)55-47(63)39(24-28(3)4)56-51(67)46(54-31(7)60)43-36-19-12-10-16-32(36)22-23-33-17-11-13-20-37(33)43/h10-21,27-30,39-41,43-46,53H,8-9,22-26H2,1-7H3,(H,54,60)(H,55,63)(H,56,67)(H,57,65)(H,58,64)(H,59,66)(H,61,62)(H,68,69)/t29-,30-,39-,40-,41-,44-,45-,46-/m0/s1
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n/an/a 4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50032181
PNG
(2-{1-[1-(2-carboxy-1-{1-[10,11-dihydro-5H-dibenzo[...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C1c2ccccc2CCc2ccccc12)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C52H67N7O10/c1-8-29(5)44(49(65)57-41(52(68)69)25-34-27-53-38-21-15-14-18-35(34)38)59-50(66)45(30(6)9-2)58-48(64)40(26-42(61)62)55-47(63)39(24-28(3)4)56-51(67)46(54-31(7)60)43-36-19-12-10-16-32(36)22-23-33-17-11-13-20-37(33)43/h10-21,27-30,39-41,43-46,53H,8-9,22-26H2,1-7H3,(H,54,60)(H,55,63)(H,56,67)(H,57,65)(H,58,64)(H,59,66)(H,61,62)(H,68,69)/t29-,30-,39-,40-,41-,44-,45-,46-/m0/s1
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n/an/a 15n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated by measuring the binding affinity at the Endothelin B receptor in rat cerebellar membranes


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369269
PNG
(CHEMBL1793932)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)CC)C(=O)NCC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C51H68N8O9/c1-8-30(5)44(59-50(67)45(31(6)9-2)58-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)49(66)54-28-41(61)39(26-42(62)63)56-48(65)40(24-29(3)4)57-51(68)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,66)(H,55,60)(H,56,65)(H,57,68)(H,58,64)(H,59,67)(H,62,63)/t30-,31-,37-,39-,40-,44-,45-,46-/m0/s1
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n/an/a 20n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369268
PNG
(CHEMBL1790519)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(C)=O)C1c2ccccc2CCc2ccccc12)C(=O)N(C)[C@H]([C@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C53H69N7O10/c1-9-30(5)45(52(68)60(8)47(31(6)10-2)51(67)58-42(53(69)70)26-35-28-54-39-22-16-15-19-36(35)39)59-49(65)41(27-43(62)63)56-48(64)40(25-29(3)4)57-50(66)46(55-32(7)61)44-37-20-13-11-17-33(37)23-24-34-18-12-14-21-38(34)44/h11-22,28-31,40-42,44-47,54H,9-10,23-27H2,1-8H3,(H,55,61)(H,56,64)(H,57,66)(H,58,67)(H,59,65)(H,62,63)(H,69,70)/t30-,31+,40-,41+,42-,45-,46+,47+/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50032172
PNG
((S)-3-[(S)-2-((S)-2-Acetylamino-3,3-diphenyl-propi...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C50H65N7O10/c1-8-29(5)42(47(63)55-39(50(66)67)25-34-27-51-36-23-17-16-22-35(34)36)57-48(64)43(30(6)9-2)56-46(62)38(26-40(59)60)53-45(61)37(24-28(3)4)54-49(65)44(52-31(7)58)41(32-18-12-10-13-19-32)33-20-14-11-15-21-33/h10-23,27-30,37-39,41-44,51H,8-9,24-26H2,1-7H3,(H,52,58)(H,53,61)(H,54,65)(H,55,63)(H,56,62)(H,57,64)(H,59,60)(H,66,67)/t29-,30-,37-,38-,39-,42-,43-,44-/m0/s1
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n/an/a 58n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369267
PNG
(CHEMBL2369736)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(50(66)58(8)45(31(6)10-2)49(65)56-40(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)57-47(63)39(27-41(60)61)54-46(62)38(25-29(3)4)55-48(64)44(53-32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,59)(H,54,62)(H,55,64)(H,56,65)(H,57,63)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369267
PNG
(CHEMBL2369736)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(50(66)58(8)45(31(6)10-2)49(65)56-40(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)57-47(63)39(27-41(60)61)54-46(62)38(25-29(3)4)55-48(64)44(53-32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,59)(H,54,62)(H,55,64)(H,56,65)(H,57,63)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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n/an/a 80n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50032172
PNG
((S)-3-[(S)-2-((S)-2-Acetylamino-3,3-diphenyl-propi...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C50H65N7O10/c1-8-29(5)42(47(63)55-39(50(66)67)25-34-27-51-36-23-17-16-22-35(34)36)57-48(64)43(30(6)9-2)56-46(62)38(26-40(59)60)53-45(61)37(24-28(3)4)54-49(65)44(52-31(7)58)41(32-18-12-10-13-19-32)33-20-14-11-15-21-33/h10-23,27-30,37-39,41-44,51H,8-9,24-26H2,1-7H3,(H,52,58)(H,53,61)(H,54,65)(H,55,63)(H,56,62)(H,57,64)(H,59,60)(H,66,67)/t29-,30-,37-,38-,39-,42-,43-,44-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration was evaluated by measuring the binding affinity at the Endothelin B receptor in rat cerebellar membranes


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369273
PNG
(CHEMBL1793926)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(48(64)55-39(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)57-49(65)44(31(6)10-2)56-46(62)38(27-41(60)61)54-47(63)40(25-29(3)4)58(8)50(66)45(53-32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,59)(H,54,63)(H,55,64)(H,56,62)(H,57,65)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369269
PNG
(CHEMBL1793932)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)CC)C(=O)NCC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C51H68N8O9/c1-8-30(5)44(59-50(67)45(31(6)9-2)58-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)49(66)54-28-41(61)39(26-42(62)63)56-48(65)40(24-29(3)4)57-51(68)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,66)(H,55,60)(H,56,65)(H,57,68)(H,58,64)(H,59,67)(H,62,63)/t30-,31-,37-,39-,40-,44-,45-,46-/m0/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369264
PNG
(CHEMBL1793929)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)CNC(=O)[C@H](NC(=O)[C@H](N)Cc1c[nH]c2ccccc12)[C@H](C)CC
Show InChI InChI=1S/C51H68N8O9/c1-8-30(5)44(41(61)28-54-50(67)45(31(6)9-2)59-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)58-49(66)40(26-42(62)63)56-48(65)39(24-29(3)4)57-51(68)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,67)(H,55,60)(H,56,65)(H,57,68)(H,58,66)(H,59,64)(H,62,63)/t30-,31-,37-,39+,40+,44-,45-,46+/m1/s1
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Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369266
PNG
(CHEMBL1793925)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C51H68N8O9/c1-8-30(5)44(59-50(67)45(31(6)9-2)58-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)49(66)57-40(26-42(62)63)48(65)54-28-41(61)39(24-29(3)4)56-51(68)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,65)(H,55,60)(H,56,68)(H,57,66)(H,58,64)(H,59,67)(H,62,63)/t30-,31-,37-,39-,40-,44-,45-,46-/m0/s1
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n/an/a>250n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369265
PNG
(CHEMBL1793928)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@H](C)CC)C(=O)CNC(=O)[C@H](N)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C51H68N8O9/c1-8-30(5)44(41(61)28-54-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)58-50(67)45(31(6)9-2)59-49(66)40(26-42(62)63)56-48(65)39(24-29(3)4)57-51(68)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,64)(H,55,60)(H,56,65)(H,57,68)(H,58,67)(H,59,66)(H,62,63)/t30-,31+,37+,39-,40-,44-,45+,46-/m0/s1
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n/an/a>250n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369264
PNG
(CHEMBL1793929)
Show SMILES CC[C@@H](C)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)CNC(=O)[C@H](NC(=O)[C@H](N)Cc1c[nH]c2ccccc12)[C@H](C)CC
Show InChI InChI=1S/C51H68N8O9/c1-8-30(5)44(41(61)28-54-50(67)45(31(6)9-2)59-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)58-49(66)40(26-42(62)63)56-48(65)39(24-29(3)4)57-51(68)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,67)(H,55,60)(H,56,65)(H,57,68)(H,58,66)(H,59,64)(H,62,63)/t30-,31-,37-,39+,40+,44-,45-,46+/m1/s1
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n/an/a 260n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369266
PNG
(CHEMBL1793925)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C51H68N8O9/c1-8-30(5)44(59-50(67)45(31(6)9-2)58-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)49(66)57-40(26-42(62)63)48(65)54-28-41(61)39(24-29(3)4)56-51(68)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,65)(H,55,60)(H,56,68)(H,57,66)(H,58,64)(H,59,67)(H,62,63)/t30-,31-,37-,39-,40-,44-,45-,46-/m0/s1
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n/an/a 260n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369273
PNG
(CHEMBL1793926)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(48(64)55-39(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)57-49(65)44(31(6)10-2)56-46(62)38(27-41(60)61)54-47(63)40(25-29(3)4)58(8)50(66)45(53-32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,59)(H,54,63)(H,55,64)(H,56,62)(H,57,65)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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n/an/a 600n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369270
PNG
(CHEMBL1793933)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H]([C@@H](C)CC)N(C)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(47(63)56-40(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)57-49(65)45(31(6)10-2)58(8)50(66)39(27-41(60)61)55-46(62)38(25-29(3)4)54-48(64)44(53-32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,59)(H,54,64)(H,55,62)(H,56,63)(H,57,65)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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n/an/a 700n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369265
PNG
(CHEMBL1793928)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@H](C)CC)C(=O)CNC(=O)[C@H](N)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C51H68N8O9/c1-8-30(5)44(41(61)28-54-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)58-50(67)45(31(6)9-2)59-49(66)40(26-42(62)63)56-48(65)39(24-29(3)4)57-51(68)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,64)(H,55,60)(H,56,65)(H,57,68)(H,58,67)(H,59,66)(H,62,63)/t30-,31+,37+,39-,40-,44-,45+,46-/m0/s1
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n/an/a 880n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369270
PNG
(CHEMBL1793933)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H]([C@@H](C)CC)N(C)C(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(47(63)56-40(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)57-49(65)45(31(6)10-2)58(8)50(66)39(27-41(60)61)55-46(62)38(25-29(3)4)54-48(64)44(53-32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,59)(H,54,64)(H,55,62)(H,56,63)(H,57,65)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369263
PNG
(CHEMBL1793924)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H]([C@H](C)CC)C(=O)N[C@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C51H68N8O9/c1-8-30(5)44(59-51(68)45(31(6)9-2)58-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)50(67)57-40(26-42(62)63)49(66)56-39(24-29(3)4)48(65)54-28-41(61)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,65)(H,55,60)(H,56,66)(H,57,67)(H,58,64)(H,59,68)(H,62,63)/t30-,31+,37+,39+,40-,44-,45+,46-/m1/s1
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n/an/a 1.30E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369271
PNG
(CHEMBL1793934)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(47(63)55-39(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)57-48(64)44(31(6)10-2)56-46(62)40(27-41(60)61)58(8)50(66)38(25-29(3)4)54-49(65)45(53-32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,59)(H,54,65)(H,55,63)(H,56,62)(H,57,64)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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n/an/a 1.50E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369263
PNG
(CHEMBL1793924)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H]([C@H](C)CC)C(=O)N[C@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C51H68N8O9/c1-8-30(5)44(59-51(68)45(31(6)9-2)58-47(64)37(52)25-35-27-53-38-23-17-16-22-36(35)38)50(67)57-40(26-42(62)63)49(66)56-39(24-29(3)4)48(65)54-28-41(61)46(55-32(7)60)43(33-18-12-10-13-19-33)34-20-14-11-15-21-34/h10-23,27,29-31,37,39-40,43-46,53H,8-9,24-26,28,52H2,1-7H3,(H,54,65)(H,55,60)(H,56,66)(H,57,67)(H,58,64)(H,59,68)(H,62,63)/t30-,31+,37+,39+,40-,44-,45+,46-/m1/s1
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n/an/a 2.70E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369271
PNG
(CHEMBL1793934)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(C)=O)C(c1ccccc1)c1ccccc1)[C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(47(63)55-39(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)57-48(64)44(31(6)10-2)56-46(62)40(27-41(60)61)58(8)50(66)38(25-29(3)4)54-49(65)45(53-32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,59)(H,54,65)(H,55,63)(H,56,62)(H,57,64)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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n/an/a 3.20E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369272
PNG
(CHEMBL1793927)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(c1ccccc1)c1ccccc1)N(C)C(C)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(48(64)55-40(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)57-49(65)44(31(6)10-2)56-47(63)39(27-41(60)61)53-46(62)38(25-29(3)4)54-50(66)45(58(8)32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,62)(H,54,66)(H,55,64)(H,56,63)(H,57,65)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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n/an/a 4.50E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369272
PNG
(CHEMBL1793927)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(c1ccccc1)c1ccccc1)N(C)C(C)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(48(64)55-40(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)57-49(65)44(31(6)10-2)56-47(63)39(27-41(60)61)53-46(62)38(25-29(3)4)54-50(66)45(58(8)32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,62)(H,54,66)(H,55,64)(H,56,63)(H,57,65)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin receptor type B


(RAT)
BDBM50369274
PNG
(CHEMBL2367550)
Show SMILES [H][C@](C)(CC)[C@]([H])(NC(=O)[C@]([H])(CC(O)=O)NC(=O)[C@]([H])(CC(C)C)NC(=O)[C@@]([H])(NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@]([H])(C(=O)N(C)[C@@]([H])(Cc1c[nH]c2ccccc12)C(O)=O)[C@@]([H])(C)CC
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(48(64)57-44(31(6)10-2)50(66)58(8)40(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)56-47(63)39(27-41(60)61)54-46(62)38(25-29(3)4)55-49(65)45(53-32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,59)(H,54,62)(H,55,65)(H,56,63)(H,57,64)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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n/an/a 1.10E+4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin B receptor of rat cerebellar membranes.


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
Endothelin-1 receptor


(Homo sapiens (Human))
BDBM50369274
PNG
(CHEMBL2367550)
Show SMILES [H][C@](C)(CC)[C@]([H])(NC(=O)[C@]([H])(CC(O)=O)NC(=O)[C@]([H])(CC(C)C)NC(=O)[C@@]([H])(NC(C)=O)C(c1ccccc1)c1ccccc1)C(=O)N[C@]([H])(C(=O)N(C)[C@@]([H])(Cc1c[nH]c2ccccc12)C(O)=O)[C@@]([H])(C)CC
Show InChI InChI=1S/C51H67N7O10/c1-9-30(5)43(48(64)57-44(31(6)10-2)50(66)58(8)40(51(67)68)26-35-28-52-37-24-18-17-23-36(35)37)56-47(63)39(27-41(60)61)54-46(62)38(25-29(3)4)55-49(65)45(53-32(7)59)42(33-19-13-11-14-20-33)34-21-15-12-16-22-34/h11-24,28-31,38-40,42-45,52H,9-10,25-27H2,1-8H3,(H,53,59)(H,54,62)(H,55,65)(H,56,63)(H,57,64)(H,60,61)(H,67,68)/t30-,31-,38-,39-,40-,43-,44-,45-/m0/s1
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n/an/a 1.10E+4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of binding to Endothelin A receptor of rabbit renal vascular smooth muscle cells


J Med Chem 40: 2228-40 (1997)


Article DOI: 10.1021/jm970161m
BindingDB Entry DOI: 10.7270/Q24T6K1W
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%