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33 similar compounds to monomer 82430

Compile data set for download or QSAR
Wt: 452.5
BDBM36640
Wt: 537.6
BDBM50041964
Wt: 550.6
BDBM50041969
Wt: 551.6
BDBM50041970
Wt: 617.6
BDBM50282699
Wt: 479.5
BDBM50281955
Wt: 547.0
BDBM50281958
Wt: 478.5
BDBM50281959
Wt: 498.5
BDBM50281962
Wt: 513.5
BDBM50281965
Wt: 465.5
BDBM50281967
Wt: 470.9
BDBM50281925
Wt: 422.4
BDBM50281926
Wt: 535.6
BDBM50281927
Wt: 451.5
BDBM50281929
Displayed 1 to 15 (of 33 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 34 hits for monomerid = 36640,50041964,50041969,50041970,50282699,50281955,50281958,50281959,50281962,50281965,50281967,50281925,50281926,50281927,50281929   
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
Metallo-beta-lactamase


(Bacteroides fragilis)
BDBM36640
PNG
(CHEMBL26514 | L-159,061)
Show SMILES CCCCc1nc2ccc(O)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C26H24N6O2/c1-2-3-8-24-27-23-14-13-19(33)15-22(23)26(34)32(24)16-17-9-11-18(12-10-17)20-6-4-5-7-21(20)25-28-30-31-29-25/h4-7,9-15,33H,2-3,8,16H2,1H3,(H,28,29,30,31)
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n/an/a 1.90E+3n/an/an/an/a7.037



Merck Research Laboratories



Assay Description
Enzyme inhibition assay by biphenyl tetrazoles (BPTS)using metallo-beta-lactamase.


Chem Biol 5: 185-96 (1998)


Article DOI: 10.1016/j.ejphar.2004.01.015
BindingDB Entry DOI: 10.7270/Q20R9MSC
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281962
PNG
(2-Butyl-6-methanesulfinyl-3-[2'-(2H-tetrazol-5-yl)...)
Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)S(C)=O
Show InChI InChI=1S/C27H26N6O2S/c1-3-4-9-25-28-24-15-14-20(36(2)35)16-23(24)27(34)33(25)17-18-10-12-19(13-11-18)21-7-5-6-8-22(21)26-29-31-32-30-26/h5-8,10-16H,3-4,9,17H2,1-2H3,(H,29,30,31,32)
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n/an/a 1n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to displace [125I]-Sar1-Ile8-AII from angiotensin II receptor, type 1 in rabbit aorta in presence of 0.2% bovine serum albumin (BSA) was dete...


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281929
PNG
(6-Amino-2-butyl-3-[2'-(1H-tetrazol-5-yl)-biphenyl-...)
Show SMILES CCCCc1nc2ccc(N)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C26H25N7O/c1-2-3-8-24-28-23-14-13-19(27)15-22(23)26(34)33(24)16-17-9-11-18(12-10-17)20-6-4-5-7-21(20)25-29-31-32-30-25/h4-7,9-15H,2-3,8,16,27H2,1H3,(H,29,30,31,32)
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n/an/a 1.30n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to displace [125I]-Sar1-Ile8-AII from angiotensin II receptor, type 1 in rabbit aorta in presence of 0.2% bovine serum albumin (BSA) was dete...


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281967
PNG
(2-Butyl-6-methylamino-3-[2'-(2H-tetrazol-5-yl)-bip...)
Show SMILES CCCCc1nc2ccc(NC)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C27H27N7O/c1-3-4-9-25-29-24-15-14-20(28-2)16-23(24)27(35)34(25)17-18-10-12-19(13-11-18)21-7-5-6-8-22(21)26-30-32-33-31-26/h5-8,10-16,28H,3-4,9,17H2,1-2H3,(H,30,31,32,33)
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to displace [125I]-Sar1-Ile8-AII from angiotensin II receptor, type 1 in rabbit aorta in presence of 0.2% bovine serum albumin (BSA) was dete...


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281955
PNG
(2-Butyl-6-dimethylamino-3-[2'-(2H-tetrazol-5-yl)-b...)
Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)N(C)C
Show InChI InChI=1S/C28H29N7O/c1-4-5-10-26-29-25-16-15-21(34(2)3)17-24(25)28(36)35(26)18-19-11-13-20(14-12-19)22-8-6-7-9-23(22)27-30-32-33-31-27/h6-9,11-17H,4-5,10,18H2,1-3H3,(H,30,31,32,33)
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n/an/a 5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to displace [125I]-Sar1-Ile8-AII from angiotensin II receptor, type 1 in rabbit aorta in presence of 0.2% bovine serum albumin (BSA) was dete...


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281959
PNG
(2-Butyl-6-isopropyl-3-[2'-(2H-tetrazol-5-yl)-biphe...)
Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(C)C
Show InChI InChI=1S/C29H30N6O/c1-4-5-10-27-30-26-16-15-22(19(2)3)17-25(26)29(36)35(27)18-20-11-13-21(14-12-20)23-8-6-7-9-24(23)28-31-33-34-32-28/h6-9,11-17,19H,4-5,10,18H2,1-3H3,(H,31,32,33,34)
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n/an/a 5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to displace [125I]-Sar1-Ile8-AII from angiotensin II receptor, type 1 in rabbit aorta in presence of 0.2% bovine serum albumin (BSA) was dete...


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM36640
PNG
(CHEMBL26514 | L-159,061)
Show SMILES CCCCc1nc2ccc(O)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C26H24N6O2/c1-2-3-8-24-27-23-14-13-19(33)15-22(23)26(34)32(24)16-17-9-11-18(12-10-17)20-6-4-5-7-21(20)25-28-30-31-29-25/h4-7,9-15,33H,2-3,8,16H2,1H3,(H,28,29,30,31)
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n/an/a 27n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to displace [125I]-Sar1-Ile8-AII from angiotensin II receptor, type 1 in rabbit aorta in presence of 0.2% bovine serum albumin (BSA) was dete...


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281927
PNG
(CHEMBL281846 | Pentanoic acid {2-butyl-4-oxo-3-[2'...)
Show SMILES CCCCC(=O)Nc1ccc2nc(CCCC)n(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)c(=O)c2c1
Show InChI InChI=1S/C31H33N7O2/c1-3-5-11-28-33-27-18-17-23(32-29(39)12-6-4-2)19-26(27)31(40)38(28)20-21-13-15-22(16-14-21)24-9-7-8-10-25(24)30-34-36-37-35-30/h7-10,13-19H,3-6,11-12,20H2,1-2H3,(H,32,39)(H,34,35,36,37)
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to displace [125I]-Sar1-Ile8-AII from angiotensin II receptor, type 1 in rabbit aorta in presence of 0.2% bovine serum albumin (BSA) was dete...


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50041970
PNG
(CHEMBL280526 | {2-Butyl-4-oxo-3-[2'-(2H-tetrazol-5...)
Show SMILES CCCCc1nc2ccc(NC(=O)OCC(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H33N7O3/c1-4-5-10-28-33-27-16-15-23(32-31(40)41-19-20(2)3)17-26(27)30(39)38(28)18-21-11-13-22(14-12-21)24-8-6-7-9-25(24)29-34-36-37-35-29/h6-9,11-17,20H,4-5,10,18-19H2,1-3H3,(H,32,40)(H,34,35,36,37)
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n/an/a 6.40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to displace [125I]-Sar1-Ile8-AII from angiotensin II receptor, type 1 in rabbit aorta in presence of 0.2% bovine serum albumin (BSA) was dete...


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281958
PNG
(2-Butyl-6-(4-chloro-phenyl)-3-[2'-(2H-tetrazol-5-y...)
Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C32H27ClN6O/c1-2-3-8-30-34-29-18-15-24(22-13-16-25(33)17-14-22)19-28(29)32(40)39(30)20-21-9-11-23(12-10-21)26-6-4-5-7-27(26)31-35-37-38-36-31/h4-7,9-19H,2-3,8,20H2,1H3,(H,35,36,37,38)
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n/an/a 30n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-Sar1-Ile8-AII (without BSA) from type 1 Angiotensin II receptor of rabbit aorta


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281962
PNG
(2-Butyl-6-methanesulfinyl-3-[2'-(2H-tetrazol-5-yl)...)
Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)S(C)=O
Show InChI InChI=1S/C27H26N6O2S/c1-3-4-9-25-28-24-15-14-20(36(2)35)16-23(24)27(34)33(25)17-18-10-12-19(13-11-18)21-7-5-6-8-22(21)26-29-31-32-30-26/h5-8,10-16H,3-4,9,17H2,1-2H3,(H,29,30,31,32)
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n/an/a 0.900n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-Sar1-Ile8-AII (without BSA) from type 1 Angiotensin II receptor of rabbit aorta


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50041969
PNG
(3-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc2ccc(NC(=O)N(C)C(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H34N8O2/c1-5-6-11-28-33-27-17-16-23(32-31(41)38(4)20(2)3)18-26(27)30(40)39(28)19-21-12-14-22(15-13-21)24-9-7-8-10-25(24)29-34-36-37-35-29/h7-10,12-18,20H,5-6,11,19H2,1-4H3,(H,32,41)(H,34,35,36,37)
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n/an/a 0.100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-Sar1-Ile8-AII (without BSA) from type 1 Angiotensin II receptor of rabbit aorta


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281965
PNG
(2-Butyl-6-pyridin-2-yl-3-[2'-(2H-tetrazol-5-yl)-bi...)
Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccn1
Show InChI InChI=1S/C31H27N7O/c1-2-3-11-29-33-28-17-16-23(27-10-6-7-18-32-27)19-26(28)31(39)38(29)20-21-12-14-22(15-13-21)24-8-4-5-9-25(24)30-34-36-37-35-30/h4-10,12-19H,2-3,11,20H2,1H3,(H,34,35,36,37)
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n/an/a 5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-Sar1-Ile8-AII (without BSA) from type 1 Angiotensin II receptor of rabbit aorta


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50282699
PNG
(CHEMBL287250 | N-{4-Oxo-2-propyl-3-[2'-(1H-tetrazo...)
Show SMILES CCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)N(C(=O)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C38H31N7O2/c1-2-11-35-39-34-23-22-30(45(29-14-7-4-8-15-29)37(46)28-12-5-3-6-13-28)24-33(34)38(47)44(35)25-26-18-20-27(21-19-26)31-16-9-10-17-32(31)36-40-42-43-41-36/h3-10,12-24H,2,11,25H2,1H3,(H,40,41,42,43)
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n/an/a 1.70n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125 I]Sar1Ile8-AII from type 1 Angiotensin II receptor of rabbit aorta membrane


Bioorg Med Chem Lett 4: 1479-1484 (1994)


Article DOI: 10.1016/S0960-894X(01)80517-5
BindingDB Entry DOI: 10.7270/Q2BC401G
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50041969
PNG
(3-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc2ccc(NC(=O)N(C)C(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H34N8O2/c1-5-6-11-28-33-27-17-16-23(32-31(41)38(4)20(2)3)18-26(27)30(40)39(28)19-21-12-14-22(15-13-21)24-9-7-8-10-25(24)29-34-36-37-35-29/h7-10,12-18,20H,5-6,11,19H2,1-4H3,(H,32,41)(H,34,35,36,37)
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n/an/a 0.100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125 I]Sar1Ile8-AII from type 1 Angiotensin II receptor of rabbit aorta membrane


Bioorg Med Chem Lett 4: 1479-1484 (1994)


Article DOI: 10.1016/S0960-894X(01)80517-5
BindingDB Entry DOI: 10.7270/Q2BC401G
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50041969
PNG
(3-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc2ccc(NC(=O)N(C)C(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H34N8O2/c1-5-6-11-28-33-27-17-16-23(32-31(41)38(4)20(2)3)18-26(27)30(40)39(28)19-21-12-14-22(15-13-21)24-9-7-8-10-25(24)29-34-36-37-35-29/h7-10,12-18,20H,5-6,11,19H2,1-4H3,(H,32,41)(H,34,35,36,37)
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n/an/a 0.100n/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Inhibitory activity was evaluated against Angiotensin II receptor, type 1 in rabbit aorta


J Med Chem 39: 625-56 (1996)


Article DOI: 10.1021/jm9504722
BindingDB Entry DOI: 10.7270/Q29P3299
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50041969
PNG
(3-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc2ccc(NC(=O)N(C)C(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H34N8O2/c1-5-6-11-28-33-27-17-16-23(32-31(41)38(4)20(2)3)18-26(27)30(40)39(28)19-21-12-14-22(15-13-21)24-9-7-8-10-25(24)29-34-36-37-35-29/h7-10,12-18,20H,5-6,11,19H2,1-4H3,(H,32,41)(H,34,35,36,37)
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n/an/a 0.100n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against AT-1 receptor from rabbit aorta using [125I]-Sar1-Ile8-Ang II without BSA


J Med Chem 36: 3207-10 (1993)


Article DOI: 10.1021/jm00073a024
BindingDB Entry DOI: 10.7270/Q2QR4W6P
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50041964
PNG
(CHEMBL110265 | {4-Oxo-2-propyl-3-[2'-(2H-tetrazol-...)
Show SMILES CCCc1nc2ccc(NC(=O)OCC(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C30H31N7O3/c1-4-7-27-32-26-15-14-22(31-30(39)40-18-19(2)3)16-25(26)29(38)37(27)17-20-10-12-21(13-11-20)23-8-5-6-9-24(23)28-33-35-36-34-28/h5-6,8-16,19H,4,7,17-18H2,1-3H3,(H,31,39)(H,33,34,35,36)
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n/an/a 3.90n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against AT-1 receptor from rabbit aorta using [125I]-Sar1-Ile8-Ang II without BSA


J Med Chem 36: 3207-10 (1993)


Article DOI: 10.1021/jm00073a024
BindingDB Entry DOI: 10.7270/Q2QR4W6P
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50041970
PNG
(CHEMBL280526 | {2-Butyl-4-oxo-3-[2'-(2H-tetrazol-5...)
Show SMILES CCCCc1nc2ccc(NC(=O)OCC(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H33N7O3/c1-4-5-10-28-33-27-16-15-23(32-31(40)41-19-20(2)3)17-26(27)30(39)38(28)18-21-11-13-22(14-12-21)24-8-6-7-9-25(24)29-34-36-37-35-29/h6-9,11-17,20H,4-5,10,18-19H2,1-3H3,(H,32,40)(H,34,35,36,37)
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n/an/a 4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against AT-1 receptor from rabbit aorta using [125I]-Sar1-Ile8-Ang II without BSA


J Med Chem 36: 3207-10 (1993)


Article DOI: 10.1021/jm00073a024
BindingDB Entry DOI: 10.7270/Q2QR4W6P
More data for this
Ligand-Target Pair
Angiotensin II AT2


(RAT)
BDBM50041964
PNG
(CHEMBL110265 | {4-Oxo-2-propyl-3-[2'-(2H-tetrazol-...)
Show SMILES CCCc1nc2ccc(NC(=O)OCC(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C30H31N7O3/c1-4-7-27-32-26-15-14-22(31-30(39)40-18-19(2)3)16-25(26)29(38)37(27)17-20-10-12-21(13-11-20)23-8-5-6-9-24(23)28-33-35-36-34-28/h5-6,8-16,19H,4,7,17-18H2,1-3H3,(H,31,39)(H,33,34,35,36)
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n/an/a 2.20E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against Angiotensin II receptor type 2 from rat mid brain using [125I]-Sar1-Ile8-Ang II without BSA


J Med Chem 36: 3207-10 (1993)


Article DOI: 10.1021/jm00073a024
BindingDB Entry DOI: 10.7270/Q2QR4W6P
More data for this
Ligand-Target Pair
Angiotensin II AT2


(RAT)
BDBM50041969
PNG
(3-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc2ccc(NC(=O)N(C)C(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H34N8O2/c1-5-6-11-28-33-27-17-16-23(32-31(41)38(4)20(2)3)18-26(27)30(40)39(28)19-21-12-14-22(15-13-21)24-9-7-8-10-25(24)29-34-36-37-35-29/h7-10,12-18,20H,5-6,11,19H2,1-4H3,(H,32,41)(H,34,35,36,37)
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n/an/a 4.50E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against Angiotensin II receptor type 2 from rat mid brain using [125I]-Sar1-Ile8-Ang II without BSA


J Med Chem 36: 3207-10 (1993)


Article DOI: 10.1021/jm00073a024
BindingDB Entry DOI: 10.7270/Q2QR4W6P
More data for this
Ligand-Target Pair
Angiotensin II AT2


(RAT)
BDBM50041970
PNG
(CHEMBL280526 | {2-Butyl-4-oxo-3-[2'-(2H-tetrazol-5...)
Show SMILES CCCCc1nc2ccc(NC(=O)OCC(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H33N7O3/c1-4-5-10-28-33-27-16-15-23(32-31(40)41-19-20(2)3)17-26(27)30(39)38(28)18-21-11-13-22(14-12-21)24-8-6-7-9-25(24)29-34-36-37-35-29/h6-9,11-17,20H,4-5,10,18-19H2,1-3H3,(H,32,40)(H,34,35,36,37)
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n/an/a 5.35E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against Angiotensin II receptor type 2 from rat mid brain using [125I]-Sar1-Ile8-Ang II without BSA


J Med Chem 36: 3207-10 (1993)


Article DOI: 10.1021/jm00073a024
BindingDB Entry DOI: 10.7270/Q2QR4W6P
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281927
PNG
(CHEMBL281846 | Pentanoic acid {2-butyl-4-oxo-3-[2'...)
Show SMILES CCCCC(=O)Nc1ccc2nc(CCCC)n(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)c(=O)c2c1
Show InChI InChI=1S/C31H33N7O2/c1-3-5-11-28-33-27-18-17-23(32-29(39)12-6-4-2)19-26(27)31(40)38(28)20-21-13-15-22(16-14-21)24-9-7-8-10-25(24)30-34-36-37-35-30/h7-10,13-19H,3-6,11-12,20H2,1-2H3,(H,32,39)(H,34,35,36,37)
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against Angiotensin II type 1 Receptor in rabbit aortic tissue


Bioorg Med Chem Lett 3: 1293-1298 (1993)


Article DOI: 10.1016/S0960-894X(00)80334-0
BindingDB Entry DOI: 10.7270/Q2FB52V1
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281929
PNG
(6-Amino-2-butyl-3-[2'-(1H-tetrazol-5-yl)-biphenyl-...)
Show SMILES CCCCc1nc2ccc(N)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C26H25N7O/c1-2-3-8-24-28-23-14-13-19(27)15-22(23)26(34)33(24)16-17-9-11-18(12-10-17)20-6-4-5-7-21(20)25-29-31-32-30-25/h4-7,9-15H,2-3,8,16,27H2,1H3,(H,29,30,31,32)
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n/an/a 1.30n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against Angiotensin II type 1 Receptor in rabbit aortic tissue


Bioorg Med Chem Lett 3: 1293-1298 (1993)


Article DOI: 10.1016/S0960-894X(00)80334-0
BindingDB Entry DOI: 10.7270/Q2FB52V1
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281925
PNG
(2-Butyl-7-chloro-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc2cc(Cl)ccc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C26H23ClN6O/c1-2-3-8-24-28-23-15-19(27)13-14-22(23)26(34)33(24)16-17-9-11-18(12-10-17)20-6-4-5-7-21(20)25-29-31-32-30-25/h4-7,9-15H,2-3,8,16H2,1H3,(H,29,30,31,32)
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n/an/a 15n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against Angiotensin II type 1 Receptor in rabbit aortic tissue


Bioorg Med Chem Lett 3: 1293-1298 (1993)


Article DOI: 10.1016/S0960-894X(00)80334-0
BindingDB Entry DOI: 10.7270/Q2FB52V1
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281926
PNG
(2-Ethyl-6-methyl-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCc1nc2ccc(C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C25H22N6O/c1-3-23-26-22-13-8-16(2)14-21(22)25(32)31(23)15-17-9-11-18(12-10-17)19-6-4-5-7-20(19)24-27-29-30-28-24/h4-14H,3,15H2,1-2H3,(H,27,28,29,30)
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n/an/a>100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against Angiotensin II type 1 Receptor in rabbit aortic tissue


Bioorg Med Chem Lett 3: 1293-1298 (1993)


Article DOI: 10.1016/S0960-894X(00)80334-0
BindingDB Entry DOI: 10.7270/Q2FB52V1
More data for this
Ligand-Target Pair
Angiotensin II AT2


(RAT)
BDBM50041969
PNG
(3-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc2ccc(NC(=O)N(C)C(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H34N8O2/c1-5-6-11-28-33-27-17-16-23(32-31(41)38(4)20(2)3)18-26(27)30(40)39(28)19-21-12-14-22(15-13-21)24-9-7-8-10-25(24)29-34-36-37-35-29/h7-10,12-18,20H,5-6,11,19H2,1-4H3,(H,32,41)(H,34,35,36,37)
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n/an/a 4.50E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125 I]Sar1Ile8-AII from AT2 receptor of rat midbrain membrane


Bioorg Med Chem Lett 4: 1479-1484 (1994)


Article DOI: 10.1016/S0960-894X(01)80517-5
BindingDB Entry DOI: 10.7270/Q2BC401G
More data for this
Ligand-Target Pair
Angiotensin II AT2


(RAT)
BDBM50282699
PNG
(CHEMBL287250 | N-{4-Oxo-2-propyl-3-[2'-(1H-tetrazo...)
Show SMILES CCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)N(C(=O)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C38H31N7O2/c1-2-11-35-39-34-23-22-30(45(29-14-7-4-8-15-29)37(46)28-12-5-3-6-13-28)24-33(34)38(47)44(35)25-26-18-20-27(21-19-26)31-16-9-10-17-32(31)36-40-42-43-41-36/h3-10,12-24H,2,11,25H2,1H3,(H,40,41,42,43)
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n/an/a 0.700n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125 I]Sar1Ile8-AII from AT2 receptor of rat midbrain membrane


Bioorg Med Chem Lett 4: 1479-1484 (1994)


Article DOI: 10.1016/S0960-894X(01)80517-5
BindingDB Entry DOI: 10.7270/Q2BC401G
More data for this
Ligand-Target Pair
Angiotensin II receptor


(Homo sapiens (Human))
BDBM50041969
PNG
(3-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc2ccc(NC(=O)N(C)C(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H34N8O2/c1-5-6-11-28-33-27-17-16-23(32-31(41)38(4)20(2)3)18-26(27)30(40)39(28)19-21-12-14-22(15-13-21)24-9-7-8-10-25(24)29-34-36-37-35-29/h7-10,12-18,20H,5-6,11,19H2,1-4H3,(H,32,41)(H,34,35,36,37)
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n/an/a 0.100n/an/an/an/an/an/a



Organon Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against angiotensin II receptor, type 1


J Med Chem 48: 6523-43 (2005)


Article DOI: 10.1021/jm058225d
BindingDB Entry DOI: 10.7270/Q2SF2WZ9
More data for this
Ligand-Target Pair
Angiotensin II receptor


(Homo sapiens (Human))
BDBM50041969
PNG
(3-{2-Butyl-4-oxo-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc2ccc(NC(=O)N(C)C(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H34N8O2/c1-5-6-11-28-33-27-17-16-23(32-31(41)38(4)20(2)3)18-26(27)30(40)39(28)19-21-12-14-22(15-13-21)24-9-7-8-10-25(24)29-34-36-37-35-29/h7-10,12-18,20H,5-6,11,19H2,1-4H3,(H,32,41)(H,34,35,36,37)
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n/an/a 4.50E+3n/an/an/an/an/an/a



Organon Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against angiotensin II receptor, type 2


J Med Chem 48: 6523-43 (2005)


Article DOI: 10.1021/jm058225d
BindingDB Entry DOI: 10.7270/Q2SF2WZ9
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50041970
PNG
(CHEMBL280526 | {2-Butyl-4-oxo-3-[2'-(2H-tetrazol-5...)
Show SMILES CCCCc1nc2ccc(NC(=O)OCC(C)C)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H33N7O3/c1-4-5-10-28-33-27-16-15-23(32-31(40)41-19-20(2)3)17-26(27)30(39)38(28)18-21-11-13-22(14-12-21)24-8-6-7-9-25(24)29-34-36-37-35-29/h6-9,11-17,20H,4-5,10,18-19H2,1-3H3,(H,32,40)(H,34,35,36,37)
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n/an/a 1.60n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-Sar1-Ile8-AII (without BSA) from type 1 Angiotensin II receptor of rabbit aorta


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281927
PNG
(CHEMBL281846 | Pentanoic acid {2-butyl-4-oxo-3-[2'...)
Show SMILES CCCCC(=O)Nc1ccc2nc(CCCC)n(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)c(=O)c2c1
Show InChI InChI=1S/C31H33N7O2/c1-3-5-11-28-33-27-18-17-23(32-29(39)12-6-4-2)19-26(27)31(40)38(28)20-21-13-15-22(16-14-21)24-9-7-8-10-25(24)30-34-36-37-35-30/h7-10,13-19H,3-6,11-12,20H2,1-2H3,(H,32,39)(H,34,35,36,37)
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n/an/a 8.90n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-Sar1-Ile8-AII (without BSA) from type 1 Angiotensin II receptor of rabbit aorta


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50281959
PNG
(2-Butyl-6-isopropyl-3-[2'-(2H-tetrazol-5-yl)-biphe...)
Show SMILES CCCCc1nc2ccc(cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(C)C
Show InChI InChI=1S/C29H30N6O/c1-4-5-10-27-30-26-16-15-22(19(2)3)17-25(26)29(36)35(27)18-20-11-13-21(14-12-20)23-8-6-7-9-24(23)28-31-33-34-32-28/h6-9,11-17,19H,4-5,10,18H2,1-3H3,(H,31,32,33,34)
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n/an/a 4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [125I]-Sar1-Ile8-AII (without BSA) from type 1 Angiotensin II receptor of rabbit aorta


Bioorg Med Chem Lett 3: 1299-1304 (1993)


Article DOI: 10.1016/S0960-894X(00)80335-2
BindingDB Entry DOI: 10.7270/Q29P31KG
More data for this
Ligand-Target Pair
Dehydropeptidase-I (DHP-1)


(Homo sapiens (Human))
BDBM36640
PNG
(CHEMBL26514 | L-159,061)
Show SMILES CCCCc1nc2ccc(O)cc2c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C26H24N6O2/c1-2-3-8-24-27-23-14-13-19(33)15-22(23)26(34)32(24)16-17-9-11-18(12-10-17)20-6-4-5-7-21(20)25-28-30-31-29-25/h4-7,9-15,33H,2-3,8,16H2,1H3,(H,28,29,30,31)
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n/an/a>1.00E+5n/an/an/an/a7.037



Merck Research Laboratories



Assay Description
Enzyme inhibition assay by biphenyl tetrazoles (BPTS)using dehydropeptidase 1 (DPH-1).


Chem Biol 5: 185-96 (1998)


Article DOI: 10.1016/j.ejphar.2004.01.015
BindingDB Entry DOI: 10.7270/Q20R9MSC
More data for this
Ligand-Target Pair