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13 similar compounds to monomer 50049189

Wt: 554.7
BDBM50141043
Wt: 566.7
BDBM50141046
Wt: 582.7
BDBM50141047
Wt: 622.8
BDBM50141049
Wt: 676.8
BDBM50141052
Wt: 610.8
BDBM50141058
Wt: 525.6
BDBM50156168
Wt: 553.7
BDBM50156172
Wt: 526.6
BDBM50156174
Wt: 558.7
BDBM50282305
Wt: 600.7
BDBM50282306
Wt: 572.7
BDBM50282307
Wt: 586.7
BDBM50282308

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 17 hits for monomerid = 50141043,50141046,50141047,50141049,50141052,50141058,50156168,50156172,50156174,50282305,50282306,50282307,50282308   
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
Angiotensin II receptor


(HUMAN)
BDBM50156172
PNG
(CHEMBL190577 | butyl (5-isobutylthien-2-yl)sulfony...)
Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3ccccc23)cc1
Show InChI InChI=1S/C29H35N3O4S2/c1-5-7-16-36-29(33)31-38(34,35)28-24(18-23(37-28)17-20(3)4)22-14-12-21(13-15-22)19-32-26-11-9-8-10-25(26)30-27(32)6-2/h8-15,18,20H,5-7,16-17,19H2,1-4H3,(H,31,33)
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3.20n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Displacement of [125I]-Ang II from pig uterus membrane angiotensin II type 2 (AT2) receptor


J Med Chem 47: 5995-6008 (2004)

More data for this
Ligand-Target Pair
Angiotensin II receptor


(HUMAN)
BDBM50156168
PNG
(CHEMBL366210 | butyl (5-isobutylthien-2-yl)sulfony...)
Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2cnc3ccccc23)cc1
Show InChI InChI=1S/C27H31N3O4S2/c1-4-5-14-34-27(31)29-36(32,33)26-23(16-22(35-26)15-19(2)3)21-12-10-20(11-13-21)17-30-18-28-24-8-6-7-9-25(24)30/h6-13,16,18-19H,4-5,14-15,17H2,1-3H3,(H,29,31)
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4n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Displacement of [125I]-Ang II from pig uterus membrane angiotensin II type 2 (AT2) receptor


J Med Chem 47: 5995-6008 (2004)

More data for this
Ligand-Target Pair
Angiotensin II receptor


(HUMAN)
BDBM50156174
PNG
(CHEMBL190811 | butyl (5-isobutylthien-2-yl)sulfony...)
Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2cnc3cccnc23)cc1
Show InChI InChI=1S/C26H30N4O4S2/c1-4-5-13-34-26(31)29-36(32,33)25-22(15-21(35-25)14-18(2)3)20-10-8-19(9-11-20)16-30-17-28-23-7-6-12-27-24(23)30/h6-12,15,17-18H,4-5,13-14,16H2,1-3H3,(H,29,31)
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7.10n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Displacement of [125I]-Ang II from pig uterus membrane angiotensin II type 2 (AT2) receptor


J Med Chem 47: 5995-6008 (2004)

More data for this
Ligand-Target Pair
Angiotensin II receptor


(HUMAN)
BDBM50141046
PNG
(3-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)
Show SMILES CCCCC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1
Show InChI InChI=1S/C30H38N4O3S2/c1-7-9-10-27(35)33-39(36,37)30-25(17-24(38-30)15-19(3)4)23-13-11-22(12-14-23)18-34-26(8-2)32-28-20(5)16-21(6)31-29(28)34/h11-14,16-17,19H,7-10,15,18H2,1-6H3,(H,33,35)
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400n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Binding affinity at Angiotensin II receptor, type 2 in pig uterus myometrial membranes by [125I]-Ang II displacement.


J Med Chem 47: 1536-46 (2004)

More data for this
Ligand-Target Pair
Angiotensin II receptor


(HUMAN)
BDBM50141049
PNG
(CHEMBL290370 | N-(3-Cyclopentanylpropionyl)-3-[4-(...)
Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1cc(CC(C)C)sc1S(=O)(=O)NC(=O)OCCC1CCCC1
Show InChI InChI=1S/C33H42N4O4S2/c1-6-29-35-30-22(4)18-23(5)34-31(30)37(29)20-25-11-13-26(14-12-25)28-19-27(17-21(2)3)42-32(28)43(39,40)36-33(38)41-16-15-24-9-7-8-10-24/h11-14,18-19,21,24H,6-10,15-17,20H2,1-5H3,(H,36,38)
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>1.00E+4n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Binding affinity at Angiotensin II receptor, type 2 in pig uterus myometrial membranes by [125I]-Ang II displacement.


J Med Chem 47: 1536-46 (2004)

More data for this
Ligand-Target Pair
Angiotensin II receptor


(HUMAN)
BDBM50141058
PNG
(CHEMBL291089 | N-Hexyloxycarbonyl-3-[4-(2-ethyl-5,...)
Show SMILES CCCCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1
Show InChI InChI=1S/C32H42N4O4S2/c1-7-9-10-11-16-40-32(37)35-42(38,39)31-27(19-26(41-31)17-21(3)4)25-14-12-24(13-15-25)20-36-28(8-2)34-29-22(5)18-23(6)33-30(29)36/h12-15,18-19,21H,7-11,16-17,20H2,1-6H3,(H,35,37)
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>1.00E+4n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Binding affinity at Angiotensin II receptor, type 2 in pig uterus myometrial membranes by [125I]-Ang II displacement.


J Med Chem 47: 1536-46 (2004)

More data for this
Ligand-Target Pair
Angiotensin II receptor


(HUMAN)
BDBM50141052
PNG
(3-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)
Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1cc(CC(C)C)sc1S(=O)(=O)NC(=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C39H40N4O3S2/c1-6-34-41-36-26(4)22-27(5)40-37(36)43(34)24-28-17-19-29(20-18-28)33-23-32(21-25(2)3)47-39(33)48(45,46)42-38(44)35(30-13-9-7-10-14-30)31-15-11-8-12-16-31/h7-20,22-23,25,35H,6,21,24H2,1-5H3,(H,42,44)
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>1.00E+4n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Binding affinity at Angiotensin II receptor, type 2 in pig uterus myometrial membranes by [125I]-Ang II displacement.


J Med Chem 47: 1536-46 (2004)

More data for this
Ligand-Target Pair
Angiotensin II receptor


(HUMAN)
BDBM50141047
PNG
(CHEMBL40563 | N-Isobutyloxycarbonyl-3-[4-(2-ethyl-...)
Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1cc(CC(C)C)sc1S(=O)(=O)NC(=O)OCC(C)C
Show InChI InChI=1S/C30H38N4O4S2/c1-8-26-32-27-20(6)14-21(7)31-28(27)34(26)16-22-9-11-23(12-10-22)25-15-24(13-18(2)3)39-29(25)40(36,37)33-30(35)38-17-19(4)5/h9-12,14-15,18-19H,8,13,16-17H2,1-7H3,(H,33,35)
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>1.00E+4n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Binding affinity at Angiotensin II receptor, type 2 in pig uterus myometrial membranes by [125I]-Ang II displacement.


J Med Chem 47: 1536-46 (2004)

More data for this
Ligand-Target Pair
Angiotensin II receptor


(HUMAN)
BDBM50141043
PNG
(CHEMBL39132 | N-Ethyloxycarbonyl-3-[4-(2-ethyl-5,7...)
Show SMILES CCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1
Show InChI InChI=1S/C28H34N4O4S2/c1-7-24-30-25-18(5)14-19(6)29-26(25)32(24)16-20-9-11-21(12-10-20)23-15-22(13-17(3)4)37-27(23)38(34,35)31-28(33)36-8-2/h9-12,14-15,17H,7-8,13,16H2,1-6H3,(H,31,33)
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>1.00E+4n/an/an/an/an/an/an/an/a



Uppsala University

Curated by ChEMBL


Assay Description
Binding affinity at Angiotensin II receptor, type 2 in pig uterus myometrial membranes by [125I]-Ang II displacement.


J Med Chem 47: 1536-46 (2004)

More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50282307
PNG
(3-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)
Show SMILES CCCc1cc(c(s1)S(=O)(=O)NC(=O)c1ccccc1)-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1
Show InChI InChI=1S/C31H32N4O3S2/c1-5-10-25-18-26(31(39-25)40(37,38)34-30(36)24-11-8-7-9-12-24)23-15-13-22(14-16-23)19-35-27(6-2)33-28-20(3)17-21(4)32-29(28)35/h7-9,11-18H,5-6,10,19H2,1-4H3,(H,34,36)
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n/an/a 5.20n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Angiotensin II receptor type 1 in rabbit aorta binding assay


Bioorg Med Chem Lett 4: 189-194 (1994)

More data for this
Ligand-Target Pair
Angiotensin II AT2


(RAT)
BDBM50282305
PNG
(5-Ethyl-3-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]p...)
Show SMILES CCc1cc(c(s1)S(=O)(=O)NC(=O)c1ccccc1)-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1
Show InChI InChI=1S/C30H30N4O3S2/c1-5-24-17-25(30(38-24)39(36,37)33-29(35)23-10-8-7-9-11-23)22-14-12-21(13-15-22)18-34-26(6-2)32-27-19(3)16-20(4)31-28(27)34/h7-17H,5-6,18H2,1-4H3,(H,33,35)
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n/an/a 900n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat midbrain angiotensin II type 2 receptor


Bioorg Med Chem Lett 4: 189-194 (1994)

More data for this
Ligand-Target Pair
Angiotensin II AT2


(RAT)
BDBM50282307
PNG
(3-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)
Show SMILES CCCc1cc(c(s1)S(=O)(=O)NC(=O)c1ccccc1)-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1
Show InChI InChI=1S/C31H32N4O3S2/c1-5-10-25-18-26(31(39-25)40(37,38)34-30(36)24-11-8-7-9-12-24)23-15-13-22(14-16-23)19-35-27(6-2)33-28-20(3)17-21(4)32-29(28)35/h7-9,11-18H,5-6,10,19H2,1-4H3,(H,34,36)
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n/an/a 130n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat midbrain angiotensin II type 2 receptor


Bioorg Med Chem Lett 4: 189-194 (1994)

More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50282306
PNG
(3-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)
Show SMILES CCCCCc1cc(c(s1)S(=O)(=O)NC(=O)c1ccccc1)-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1
Show InChI InChI=1S/C33H36N4O3S2/c1-5-7-9-14-27-20-28(33(41-27)42(39,40)36-32(38)26-12-10-8-11-13-26)25-17-15-24(16-18-25)21-37-29(6-2)35-30-22(3)19-23(4)34-31(30)37/h8,10-13,15-20H,5-7,9,14,21H2,1-4H3,(H,36,38)
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n/an/a 7.5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Angiotensin II receptor type 1 in rabbit aorta binding assay


Bioorg Med Chem Lett 4: 189-194 (1994)

More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50282305
PNG
(5-Ethyl-3-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]p...)
Show SMILES CCc1cc(c(s1)S(=O)(=O)NC(=O)c1ccccc1)-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1
Show InChI InChI=1S/C30H30N4O3S2/c1-5-24-17-25(30(38-24)39(36,37)33-29(35)23-10-8-7-9-11-23)22-14-12-21(13-15-22)18-34-26(6-2)32-27-19(3)16-20(4)31-28(27)34/h7-17H,5-6,18H2,1-4H3,(H,33,35)
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n/an/a 10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Angiotensin II receptor type 1 in rabbit aorta binding assay


Bioorg Med Chem Lett 4: 189-194 (1994)

More data for this
Ligand-Target Pair
Angiotensin II AT2


(RAT)
BDBM50282308
PNG
(3-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)
Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1cc(CC(C)C)sc1S(=O)(=O)NC(=O)c1ccccc1
Show InChI InChI=1S/C32H34N4O3S2/c1-6-28-34-29-21(4)17-22(5)33-30(29)36(28)19-23-12-14-24(15-13-23)27-18-26(16-20(2)3)40-32(27)41(38,39)35-31(37)25-10-8-7-9-11-25/h7-15,17-18,20H,6,16,19H2,1-5H3,(H,35,37)
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n/an/a 22n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of rat midbrain angiotensin II type 2 receptor


Bioorg Med Chem Lett 4: 189-194 (1994)

More data for this
Ligand-Target Pair
Angiotensin II AT2


(RAT)
BDBM50282306
PNG
(3-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)
Show SMILES CCCCCc1cc(c(s1)S(=O)(=O)NC(=O)c1ccccc1)-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1
Show InChI InChI=1S/C33H36N4O3S2/c1-5-7-9-14-27-20-28(33(41-27)42(39,40)36-32(38)26-12-10-8-11-13-26)25-17-15-24(16-18-25)21-37-29(6-2)35-30-22(3)19-23(4)34-31(30)37/h8,10-13,15-20H,5-7,9,14,21H2,1-4H3,(H,36,38)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of rat midbrain angiotensin II type 2 receptor


Bioorg Med Chem Lett 4: 189-194 (1994)

More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(RABBIT)
BDBM50282308
PNG
(3-[4-(2-Ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3...)
Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1cc(CC(C)C)sc1S(=O)(=O)NC(=O)c1ccccc1
Show InChI InChI=1S/C32H34N4O3S2/c1-6-28-34-29-21(4)17-22(5)33-30(29)36(28)19-23-12-14-24(15-13-23)27-18-26(16-20(2)3)40-32(27)41(38,39)35-31(37)25-10-8-7-9-11-25/h7-15,17-18,20H,6,16,19H2,1-5H3,(H,35,37)
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TBA

Curated by ChEMBL


Assay Description
Inhibition of Angiotensin II receptor type 1 in rabbit aorta binding assay


Bioorg Med Chem Lett 4: 189-194 (1994)

More data for this
Ligand-Target Pair