Found 79 hits with Last Name = 'rosenström' and Initial = 'u' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50370575
(CHEMBL1791308)Show SMILES CC[C@@H](C)[C@H](N1Cc2cccc(NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)C(C)C)c2N[C@@H](Cc2ccc(O)cc2)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |wU:68.73,15.15,55.57,41.42,30.30,2.2,wD:4.4,19.26,72.76,(20.86,-11.16,;20.86,-9.62,;19.5,-8.85,;18.13,-9.62,;19.5,-7.31,;18.13,-6.53,;17.29,-7.83,;15.7,-8,;15.29,-9.47,;13.78,-9.86,;12.67,-8.77,;13.1,-7.3,;11.74,-6.61,;10.41,-7.27,;10.41,-8.62,;9.06,-6.59,;7.72,-7.27,;6.37,-6.59,;6.4,-5.24,;5.03,-7.24,;5.03,-8.61,;6.22,-9.28,;6.2,-10.63,;7.41,-11.31,;7.4,-12.65,;6.2,-13.32,;8.58,-13.35,;3.69,-6.58,;2.35,-7.24,;2.35,-8.58,;.99,-6.58,;-.35,-7.21,;1.02,-5.24,;-.33,-4.54,;-1.69,-5.21,;-.32,-3.2,;9.07,-5.22,;10.45,-4.54,;7.71,-4.51,;14.61,-6.9,;14.8,-5.36,;16.14,-4.57,;15.99,-3.04,;16.77,-1.69,;15.97,-.38,;16.74,.97,;18.32,.97,;19.09,2.32,;19.13,-.34,;18.35,-1.69,;17.63,-5.09,;18.76,-3.99,;20.86,-6.53,;20.86,-5,;22.25,-7.3,;23.67,-6.69,;23.73,-5.14,;24.52,-3.79,;26.07,-3.63,;26.4,-2.11,;25.03,-1.35,;23.84,-2.38,;25,-7.41,;24.92,-8.77,;26.39,-6.67,;25.88,-5.19,;27.18,-4.28,;28.45,-5.19,;27.97,-6.67,;29.35,-7.43,;29.34,-8.98,;30.71,-6.67,;32.02,-7.41,;31.94,-8.77,;33.27,-9.48,;34.67,-8.88,;35.98,-9.63,;35.9,-10.95,;34.48,-11.61,;33.19,-10.87,;33.44,-6.8,;34.77,-7.53,;33.52,-5.43,)| Show InChI InChI=1S/C57H76N14O12/c1-5-32(4)48(53(79)67-42(26-36-28-61-30-63-36)54(80)70-23-11-17-44(70)51(77)68-43(56(82)83)25-33-12-7-6-8-13-33)71-29-35-14-9-15-39(47(35)64-41(55(71)81)24-34-18-20-37(72)21-19-34)65-52(78)46(31(2)3)69-50(76)40(16-10-22-62-57(59)60)66-49(75)38(58)27-45(73)74/h6-9,12-15,18-21,28,30-32,38,40-44,46,48,64,72H,5,10-11,16-17,22-27,29,58H2,1-4H3,(H,61,63)(H,65,78)(H,66,75)(H,67,79)(H,68,77)(H,69,76)(H,73,74)(H,82,83)(H4,59,60,62)/t32-,38+,40+,41+,42+,43+,44+,46+,48+/m1/s1 | PDB
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PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus myometrium |
J Med Chem 48: 4009-24 (2005)
Article DOI: 10.1021/jm0491492
BindingDB Entry DOI: 10.7270/Q2BR8SZD |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50370575
(CHEMBL1791308)Show SMILES CC[C@@H](C)[C@H](N1Cc2cccc(NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)C(C)C)c2N[C@@H](Cc2ccc(O)cc2)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |wU:68.73,15.15,55.57,41.42,30.30,2.2,wD:4.4,19.26,72.76,(20.86,-11.16,;20.86,-9.62,;19.5,-8.85,;18.13,-9.62,;19.5,-7.31,;18.13,-6.53,;17.29,-7.83,;15.7,-8,;15.29,-9.47,;13.78,-9.86,;12.67,-8.77,;13.1,-7.3,;11.74,-6.61,;10.41,-7.27,;10.41,-8.62,;9.06,-6.59,;7.72,-7.27,;6.37,-6.59,;6.4,-5.24,;5.03,-7.24,;5.03,-8.61,;6.22,-9.28,;6.2,-10.63,;7.41,-11.31,;7.4,-12.65,;6.2,-13.32,;8.58,-13.35,;3.69,-6.58,;2.35,-7.24,;2.35,-8.58,;.99,-6.58,;-.35,-7.21,;1.02,-5.24,;-.33,-4.54,;-1.69,-5.21,;-.32,-3.2,;9.07,-5.22,;10.45,-4.54,;7.71,-4.51,;14.61,-6.9,;14.8,-5.36,;16.14,-4.57,;15.99,-3.04,;16.77,-1.69,;15.97,-.38,;16.74,.97,;18.32,.97,;19.09,2.32,;19.13,-.34,;18.35,-1.69,;17.63,-5.09,;18.76,-3.99,;20.86,-6.53,;20.86,-5,;22.25,-7.3,;23.67,-6.69,;23.73,-5.14,;24.52,-3.79,;26.07,-3.63,;26.4,-2.11,;25.03,-1.35,;23.84,-2.38,;25,-7.41,;24.92,-8.77,;26.39,-6.67,;25.88,-5.19,;27.18,-4.28,;28.45,-5.19,;27.97,-6.67,;29.35,-7.43,;29.34,-8.98,;30.71,-6.67,;32.02,-7.41,;31.94,-8.77,;33.27,-9.48,;34.67,-8.88,;35.98,-9.63,;35.9,-10.95,;34.48,-11.61,;33.19,-10.87,;33.44,-6.8,;34.77,-7.53,;33.52,-5.43,)| Show InChI InChI=1S/C57H76N14O12/c1-5-32(4)48(53(79)67-42(26-36-28-61-30-63-36)54(80)70-23-11-17-44(70)51(77)68-43(56(82)83)25-33-12-7-6-8-13-33)71-29-35-14-9-15-39(47(35)64-41(55(71)81)24-34-18-20-37(72)21-19-34)65-52(78)46(31(2)3)69-50(76)40(16-10-22-62-57(59)60)66-49(75)38(58)27-45(73)74/h6-9,12-15,18-21,28,30-32,38,40-44,46,48,64,72H,5,10-11,16-17,22-27,29,58H2,1-4H3,(H,61,63)(H,65,78)(H,66,75)(H,67,79)(H,68,77)(H,69,76)(H,73,74)(H,82,83)(H4,59,60,62)/t32-,38+,40+,41+,42+,43+,44+,46+,48+/m1/s1 | PDB
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| Article
PubMed
| 0.300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus myometrium |
J Med Chem 48: 4009-24 (2005)
Article DOI: 10.1021/jm0491492
BindingDB Entry DOI: 10.7270/Q2BR8SZD |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50156173
((1-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Show InChI InChI=1S/C23H29N3O4S2/c1-4-5-12-30-23(27)25-32(28,29)22-21(14-20(31-22)13-17(2)3)19-8-6-18(7-9-19)15-26-11-10-24-16-26/h6-11,14,16-17H,4-5,12-13,15H2,1-3H3,(H,25,27) | PDB
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PubMed
| 0.400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50139783
(Angiotensin II analogue | CHEMBL404996)Show SMILES CCSC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C47H65N13O12S2/c1-2-74-24-36(43(68)56-33(20-28-22-51-25-53-28)45(70)60-17-7-11-37(60)44(69)57-34(46(71)72)19-26-8-4-3-5-9-26)59-41(66)32(18-27-12-14-29(61)15-13-27)55-42(67)35(23-73)58-40(65)31(10-6-16-52-47(49)50)54-39(64)30(48)21-38(62)63/h3-5,8-9,12-15,22,25,30-37,61,73H,2,6-7,10-11,16-21,23-24,48H2,1H3,(H,51,53)(H,54,64)(H,55,67)(H,56,68)(H,57,69)(H,58,65)(H,59,66)(H,62,63)(H,71,72)(H4,49,50,52)/t30-,31-,32-,33-,34-,35-,36-,37-/m0/s1 | PDB
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PubMed
| 0.620 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Binding affinity for Angiotensin II receptor type 2 using [125I]- Ang II in pig uterus myometrium |
J Med Chem 47: 859-70 (2004)
Article DOI: 10.1021/jm030921v
BindingDB Entry DOI: 10.7270/Q2736RNQ |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50370375
(CHEMBL268815)Show SMILES [#6]-[#6]-[#6@@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6](-[#8])=O)-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#7])cc1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O Show InChI InChI=1S/C53H74N12O12/c1-5-30(4)44(50(74)61-39(26-32-15-19-34(54)20-16-32)51(75)65-24-10-14-41(65)48(72)62-40(52(76)77)27-31-11-7-6-8-12-31)64-47(71)38(25-33-17-21-35(66)22-18-33)60-49(73)43(29(2)3)63-46(70)37(13-9-23-58-53(56)57)59-45(69)36(55)28-42(67)68/h6-8,11-12,15-22,29-30,36-41,43-44,66H,5,9-10,13-14,23-28,54-55H2,1-4H3,(H,59,69)(H,60,73)(H,61,74)(H,62,72)(H,63,70)(H,64,71)(H,67,68)(H,76,77)(H4,56,57,58)/t30-,36+,37+,38+,39+,40+,41+,43+,44+/m1/s1 | PDB
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PubMed
| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]Ang2 from AT2 receptor in pig uterus myometrium |
J Med Chem 49: 6133-7 (2006)
Article DOI: 10.1021/jm051222g
BindingDB Entry DOI: 10.7270/Q28P619Q |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50199326
(CHEMBL217673 | N-butyloxycarbonyl-2-(4-imidazol-1-...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1ccc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Show InChI InChI=1S/C25H31N3O4S/c1-4-5-14-32-25(29)27-33(30,31)24-11-8-21(15-19(2)3)16-23(24)22-9-6-20(7-10-22)17-28-13-12-26-18-28/h6-13,16,18-19H,4-5,14-15,17H2,1-3H3,(H,27,29) | PDB
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| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50141059
(CHEMBL289614 | L-162782 | N-Butyloxycarbonyl-4'-(2...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1ccc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1 Show InChI InChI=1S/C32H40N4O4S/c1-7-9-16-40-32(37)35-41(38,39)28-15-12-25(17-21(3)4)19-27(28)26-13-10-24(11-14-26)20-36-29(8-2)34-30-22(5)18-23(6)33-31(30)36/h10-15,18-19,21H,7-9,16-17,20H2,1-6H3,(H,35,37) | PDB
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PubMed
| 0.700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50168428
((3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(2S)-4-({[(2S)-...)Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC(O)=O)C(=O)Nc1cccc2CN(CC(=O)N[C@@H](Cc3cnc[nH]3)C(=O)N3CCC[C@H]3C(=O)N[C@@H](Cc3ccccc3)C(O)=O)C(=O)[C@H](Cc3ccc(O)cc3)Nc12 Show InChI InChI=1S/C53H68N14O12/c1-29(2)44(65-47(73)37(13-7-19-58-53(55)56)63-46(72)35(54)24-43(70)71)49(75)62-36-12-6-11-32-26-66(50(76)38(61-45(32)36)21-31-15-17-34(68)18-16-31)27-42(69)60-39(23-33-25-57-28-59-33)51(77)67-20-8-14-41(67)48(74)64-40(52(78)79)22-30-9-4-3-5-10-30/h3-6,9-12,15-18,25,28-29,35,37-41,44,61,68H,7-8,13-14,19-24,26-27,54H2,1-2H3,(H,57,59)(H,60,69)(H,62,75)(H,63,72)(H,64,74)(H,65,73)(H,70,71)(H,78,79)(H4,55,56,58)/t35-,37-,38-,39-,40-,41-,44-/m0/s1 | PDB
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| 0.800 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus myometrium |
J Med Chem 48: 4009-24 (2005)
Article DOI: 10.1021/jm0491492
BindingDB Entry DOI: 10.7270/Q2BR8SZD |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50370375
(CHEMBL268815)Show SMILES [#6]-[#6]-[#6@@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6](-[#8])=O)-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#7])cc1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O Show InChI InChI=1S/C53H74N12O12/c1-5-30(4)44(50(74)61-39(26-32-15-19-34(54)20-16-32)51(75)65-24-10-14-41(65)48(72)62-40(52(76)77)27-31-11-7-6-8-12-31)64-47(71)38(25-33-17-21-35(66)22-18-33)60-49(73)43(29(2)3)63-46(70)37(13-9-23-58-53(56)57)59-45(69)36(55)28-42(67)68/h6-8,11-12,15-22,29-30,36-41,43-44,66H,5,9-10,13-14,23-28,54-55H2,1-4H3,(H,59,69)(H,60,73)(H,61,74)(H,62,72)(H,63,70)(H,64,71)(H,67,68)(H,76,77)(H4,56,57,58)/t30-,36+,37+,38+,39+,40+,41+,43+,44+/m1/s1 | PDB
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| 0.900 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus myometrium |
J Med Chem 48: 4009-24 (2005)
Article DOI: 10.1021/jm0491492
BindingDB Entry DOI: 10.7270/Q2BR8SZD |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251514
(CHEMBL480906 | N-Butoxycarbonyl-3-[4-(N-benzylcarb...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)NCc1ccccc1 Show InChI InChI=1S/C27H32N2O5S2/c1-4-5-15-34-27(31)29-36(32,33)26-24(17-23(35-26)16-19(2)3)21-11-13-22(14-12-21)25(30)28-18-20-9-7-6-8-10-20/h6-14,17,19H,4-5,15-16,18H2,1-3H3,(H,28,30)(H,29,31) | PDB
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| 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor A
(RAT) | BDBM50049189
(3-[4-(2-Ethyl-57-dimethyl-imidazo[45-b]pyridin-3-y...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1 Show InChI InChI=1S/C30H38N4O4S2/c1-7-9-14-38-30(35)33-40(36,37)29-25(17-24(39-29)15-19(3)4)23-12-10-22(11-13-23)18-34-26(8-2)32-27-20(5)16-21(6)31-28(27)34/h10-13,16-17,19H,7-9,14-15,18H2,1-6H3,(H,33,35) | PDB
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| 1.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT1 receptor in rat liver membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50195697
((3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(2S)-2-[(2S)-bu...)Show SMILES CC[C@H](C)[C@@H]1Nc2c(Cc3ccc(O)cc3)cc(NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)C(C)C)cc2CN(CC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccccc2)C(O)=O)C1=O |wU:25.33,70.73,4.3,2.2,wD:53.54,36.37,21.22,66.70,(14.02,-9.64,;14.01,-11.18,;12.68,-11.94,;11.35,-11.17,;12.67,-13.48,;11.16,-13.15,;9.94,-14.11,;8.6,-13.34,;8.6,-11.8,;7.26,-11.03,;7.27,-9.49,;5.93,-8.73,;4.6,-9.5,;3.26,-8.73,;4.61,-11.05,;5.95,-11.81,;7.28,-14.11,;7.28,-15.65,;5.96,-16.41,;4.62,-15.64,;4.62,-14.1,;3.28,-16.41,;1.95,-15.64,;.62,-16.41,;.62,-17.95,;-.72,-15.64,;-.72,-14.1,;-2.05,-13.33,;-2.05,-11.79,;-3.38,-11.02,;-3.38,-9.48,;-4.71,-8.71,;-2.05,-8.71,;-2.05,-16.41,;-3.38,-15.64,;-3.38,-14.1,;-4.71,-16.41,;-6.05,-15.64,;-4.71,-17.95,;-6.05,-18.72,;-7.39,-17.95,;-6.05,-20.26,;3.28,-17.95,;1.95,-18.72,;4.62,-18.72,;8.61,-16.42,;9.94,-15.65,;11.15,-16.63,;12.67,-16.28,;13.62,-17.48,;15.16,-17.51,;15.91,-18.86,;15.96,-16.19,;17.5,-16.21,;18.65,-17.24,;18.55,-18.78,;19.77,-19.74,;19.16,-21.18,;17.62,-21.06,;17.26,-19.56,;18.25,-14.87,;17.46,-13.55,;19.79,-14.86,;20.14,-16.33,;21.66,-16.52,;22.26,-15.08,;21.07,-14.07,;21.07,-12.53,;19.73,-11.76,;22.4,-11.75,;22.43,-10.22,;21.11,-9.42,;21.13,-7.87,;22.48,-7.13,;22.51,-5.6,;21.19,-4.8,;19.85,-5.53,;19.81,-7.08,;23.77,-9.47,;23.8,-7.93,;25.09,-10.26,;13.34,-14.88,;14.88,-14.88,)| Show InChI InChI=1S/C57H76N14O12/c1-5-32(4)48-55(81)70(29-45(73)65-42(25-38-27-61-30-63-38)54(80)71-20-10-14-44(71)52(78)67-43(56(82)83)22-33-11-7-6-8-12-33)28-36-24-37(23-35(49(36)68-48)21-34-15-17-39(72)18-16-34)64-53(79)47(31(2)3)69-51(77)41(13-9-19-62-57(59)60)66-50(76)40(58)26-46(74)75/h6-8,11-12,15-18,23-24,27,30-32,40-44,47-48,68,72H,5,9-10,13-14,19-22,25-26,28-29,58H2,1-4H3,(H,61,63)(H,64,79)(H,65,73)(H,66,76)(H,67,78)(H,69,77)(H,74,75)(H,82,83)(H4,59,60,62)/t32-,40-,41-,42-,43-,44-,47-,48-/m0/s1 | PDB
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| 1.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]Ang2 from AT2 receptor in pig uterus myometrium |
J Med Chem 49: 6133-7 (2006)
Article DOI: 10.1021/jm051222g
BindingDB Entry DOI: 10.7270/Q28P619Q |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50049189
(3-[4-(2-Ethyl-57-dimethyl-imidazo[45-b]pyridin-3-y...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1 Show InChI InChI=1S/C30H38N4O4S2/c1-7-9-14-38-30(35)33-40(36,37)29-25(17-24(39-29)15-19(3)4)23-12-10-22(11-13-23)18-34-26(8-2)32-27-20(5)16-21(6)31-28(27)34/h10-13,16-17,19H,7-9,14-15,18H2,1-6H3,(H,33,35) | PDB
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| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor A
(RAT) | BDBM50141059
(CHEMBL289614 | L-162782 | N-Butyloxycarbonyl-4'-(2...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1ccc(CC(C)C)cc1-c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1 Show InChI InChI=1S/C32H40N4O4S/c1-7-9-16-40-32(37)35-41(38,39)28-15-12-25(17-21(3)4)19-27(28)26-13-10-24(11-14-26)20-36-29(8-2)34-30-22(5)18-23(6)33-31(30)36/h10-15,18-19,21H,7-9,16-17,20H2,1-6H3,(H,35,37) | PDB
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| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT1 receptor in rat liver membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50370375
(CHEMBL268815)Show SMILES [#6]-[#6]-[#6@@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6](-[#8])=O)-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#7])cc1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O Show InChI InChI=1S/C53H74N12O12/c1-5-30(4)44(50(74)61-39(26-32-15-19-34(54)20-16-32)51(75)65-24-10-14-41(65)48(72)62-40(52(76)77)27-31-11-7-6-8-12-31)64-47(71)38(25-33-17-21-35(66)22-18-33)60-49(73)43(29(2)3)63-46(70)37(13-9-23-58-53(56)57)59-45(69)36(55)28-42(67)68/h6-8,11-12,15-22,29-30,36-41,43-44,66H,5,9-10,13-14,23-28,54-55H2,1-4H3,(H,59,69)(H,60,73)(H,61,74)(H,62,72)(H,63,70)(H,64,71)(H,67,68)(H,76,77)(H4,56,57,58)/t30-,36+,37+,38+,39+,40+,41+,43+,44+/m1/s1 | PDB
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| 2.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Binding affinity for Angiotensin II receptor type 2 using [125I]- Ang II in pig uterus myometrium |
J Med Chem 47: 859-70 (2004)
Article DOI: 10.1021/jm030921v
BindingDB Entry DOI: 10.7270/Q2736RNQ |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50370576
(CHEMBL1791309)Show SMILES CC[C@@H](C)[C@H](N1Cc2cccc(NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)c2N[C@@H](Cc2ccc(O)cc2)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |wU:61.66,48.50,15.22,34.35,2.2,wD:4.4,65.69,26.26,(17.04,-11.58,;17.04,-10.04,;15.66,-9.27,;14.31,-10.04,;15.66,-7.73,;14.31,-6.96,;13.45,-8.27,;11.88,-8.43,;11.49,-9.89,;9.96,-10.28,;8.85,-9.2,;9.27,-7.73,;7.91,-6.94,;6.57,-7.6,;6.59,-8.95,;5.22,-6.94,;5.22,-5.59,;3.89,-4.92,;3.91,-3.59,;2.54,-2.91,;2.56,-1.57,;1.23,-.89,;3.92,-.92,;3.91,-7.62,;2.54,-6.94,;2.54,-5.61,;1.2,-7.62,;-.15,-6.96,;1.2,-8.95,;-.12,-9.64,;-1.47,-8.98,;-.11,-10.97,;10.79,-7.33,;10.97,-5.81,;12.32,-5.01,;12.16,-3.47,;12.94,-2.15,;14.52,-2.12,;15.29,-.81,;14.5,.52,;15.27,1.86,;12.91,.49,;12.14,-.84,;13.8,-5.53,;14.93,-4.46,;17.04,-6.96,;17.04,-5.43,;18.42,-7.73,;19.82,-7.11,;19.89,-5.56,;20.67,-4.25,;22.22,-4.06,;22.54,-2.56,;21.18,-1.8,;20.01,-2.83,;21.14,-7.82,;21.05,-9.2,;22.54,-7.1,;22.04,-5.64,;23.33,-4.73,;24.61,-5.64,;24.12,-7.1,;25.48,-7.86,;25.48,-9.4,;26.86,-7.11,;28.17,-7.85,;28.07,-9.22,;29.42,-9.91,;29.32,-11.29,;30.62,-12.02,;32.03,-11.39,;32.13,-10.05,;30.8,-9.29,;29.59,-7.23,;30.9,-7.96,;29.66,-5.86,)| Show InChI InChI=1S/C52H67N13O11/c1-3-29(2)44(48(72)62-39(24-33-26-56-28-58-33)49(73)64-21-9-15-41(64)47(71)63-40(51(75)76)23-30-10-5-4-6-11-30)65-27-32-12-7-13-36(43(32)59-38(50(65)74)22-31-16-18-34(66)19-17-31)60-46(70)37(14-8-20-57-52(54)55)61-45(69)35(53)25-42(67)68/h4-7,10-13,16-19,26,28-29,35,37-41,44,59,66H,3,8-9,14-15,20-25,27,53H2,1-2H3,(H,56,58)(H,60,70)(H,61,69)(H,62,72)(H,63,71)(H,67,68)(H,75,76)(H4,54,55,57)/t29-,35+,37+,38+,39+,40+,41+,44+/m1/s1 | PDB
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| 2.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus myometrium |
J Med Chem 48: 4009-24 (2005)
Article DOI: 10.1021/jm0491492
BindingDB Entry DOI: 10.7270/Q2BR8SZD |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251489
(CHEMBL481089 | butyl 5-isobutyl-3-(4-(isopropylcar...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)NC(C)C Show InChI InChI=1S/C23H32N2O5S2/c1-6-7-12-30-23(27)25-32(28,29)22-20(14-19(31-22)13-15(2)3)17-8-10-18(11-9-17)21(26)24-16(4)5/h8-11,14-16H,6-7,12-13H2,1-5H3,(H,24,26)(H,25,27) | PDB
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| 2.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50370576
(CHEMBL1791309)Show SMILES CC[C@@H](C)[C@H](N1Cc2cccc(NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)c2N[C@@H](Cc2ccc(O)cc2)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |wU:61.66,48.50,15.22,34.35,2.2,wD:4.4,65.69,26.26,(17.04,-11.58,;17.04,-10.04,;15.66,-9.27,;14.31,-10.04,;15.66,-7.73,;14.31,-6.96,;13.45,-8.27,;11.88,-8.43,;11.49,-9.89,;9.96,-10.28,;8.85,-9.2,;9.27,-7.73,;7.91,-6.94,;6.57,-7.6,;6.59,-8.95,;5.22,-6.94,;5.22,-5.59,;3.89,-4.92,;3.91,-3.59,;2.54,-2.91,;2.56,-1.57,;1.23,-.89,;3.92,-.92,;3.91,-7.62,;2.54,-6.94,;2.54,-5.61,;1.2,-7.62,;-.15,-6.96,;1.2,-8.95,;-.12,-9.64,;-1.47,-8.98,;-.11,-10.97,;10.79,-7.33,;10.97,-5.81,;12.32,-5.01,;12.16,-3.47,;12.94,-2.15,;14.52,-2.12,;15.29,-.81,;14.5,.52,;15.27,1.86,;12.91,.49,;12.14,-.84,;13.8,-5.53,;14.93,-4.46,;17.04,-6.96,;17.04,-5.43,;18.42,-7.73,;19.82,-7.11,;19.89,-5.56,;20.67,-4.25,;22.22,-4.06,;22.54,-2.56,;21.18,-1.8,;20.01,-2.83,;21.14,-7.82,;21.05,-9.2,;22.54,-7.1,;22.04,-5.64,;23.33,-4.73,;24.61,-5.64,;24.12,-7.1,;25.48,-7.86,;25.48,-9.4,;26.86,-7.11,;28.17,-7.85,;28.07,-9.22,;29.42,-9.91,;29.32,-11.29,;30.62,-12.02,;32.03,-11.39,;32.13,-10.05,;30.8,-9.29,;29.59,-7.23,;30.9,-7.96,;29.66,-5.86,)| Show InChI InChI=1S/C52H67N13O11/c1-3-29(2)44(48(72)62-39(24-33-26-56-28-58-33)49(73)64-21-9-15-41(64)47(71)63-40(51(75)76)23-30-10-5-4-6-11-30)65-27-32-12-7-13-36(43(32)59-38(50(65)74)22-31-16-18-34(66)19-17-31)60-46(70)37(14-8-20-57-52(54)55)61-45(69)35(53)25-42(67)68/h4-7,10-13,16-19,26,28-29,35,37-41,44,59,66H,3,8-9,14-15,20-25,27,53H2,1-2H3,(H,56,58)(H,60,70)(H,61,69)(H,62,72)(H,63,71)(H,67,68)(H,75,76)(H4,54,55,57)/t29-,35+,37+,38+,39+,40+,41+,44+/m1/s1 | PDB
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| 2.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus myometrium |
J Med Chem 48: 4009-24 (2005)
Article DOI: 10.1021/jm0491492
BindingDB Entry DOI: 10.7270/Q2BR8SZD |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50168424
((3S)-3-amino-3-{[(1S)-1-{[(2S)-4-({[(2S)-1-[(2S)-2...)Show SMILES N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)Nc1cccc2CN(CC(=O)N[C@@H](Cc3cnc[nH]3)C(=O)N3CCC[C@H]3C(=O)N[C@@H](Cc3ccccc3)C(O)=O)C(=O)[C@H](Cc3ccc(O)cc3)Nc12 Show InChI InChI=1S/C48H59N13O11/c49-32(22-40(64)65)42(66)58-34(11-5-17-53-48(50)51)43(67)57-33-10-4-9-29-24-60(45(69)35(56-41(29)33)19-28-13-15-31(62)16-14-28)25-39(63)55-36(21-30-23-52-26-54-30)46(70)61-18-6-12-38(61)44(68)59-37(47(71)72)20-27-7-2-1-3-8-27/h1-4,7-10,13-16,23,26,32,34-38,56,62H,5-6,11-12,17-22,24-25,49H2,(H,52,54)(H,55,63)(H,57,67)(H,58,66)(H,59,68)(H,64,65)(H,71,72)(H4,50,51,53)/t32-,34-,35-,36-,37-,38-/m0/s1 | PDB
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PubMed
| 2.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus myometrium |
J Med Chem 48: 4009-24 (2005)
Article DOI: 10.1021/jm0491492
BindingDB Entry DOI: 10.7270/Q2BR8SZD |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50139787
((3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(2S)-4-({[(2S)-...)Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC(O)=O)C(=O)Nc1ccc2N[C@@H](Cc3ccc(O)cc3)C(=O)N(CC(=O)N[C@@H](Cc3cnc[nH]3)C(=O)N3CCC[C@H]3C(=O)N[C@@H](Cc3ccccc3)C(O)=O)Cc2c1 Show InChI InChI=1S/C53H68N14O12/c1-29(2)45(65-47(73)38(10-6-18-58-53(55)56)63-46(72)36(54)24-44(70)71)49(75)60-33-14-17-37-32(22-33)26-66(50(76)39(61-37)20-31-12-15-35(68)16-13-31)27-43(69)62-40(23-34-25-57-28-59-34)51(77)67-19-7-11-42(67)48(74)64-41(52(78)79)21-30-8-4-3-5-9-30/h3-5,8-9,12-17,22,25,28-29,36,38-42,45,61,68H,6-7,10-11,18-21,23-24,26-27,54H2,1-2H3,(H,57,59)(H,60,75)(H,62,69)(H,63,72)(H,64,74)(H,65,73)(H,70,71)(H,78,79)(H4,55,56,58)/t36-,38-,39-,40-,41-,42-,45-/m0/s1 | PDB
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| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus myometrium |
J Med Chem 48: 4009-24 (2005)
Article DOI: 10.1021/jm0491492
BindingDB Entry DOI: 10.7270/Q2BR8SZD |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50139787
((3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(2S)-4-({[(2S)-...)Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC(O)=O)C(=O)Nc1ccc2N[C@@H](Cc3ccc(O)cc3)C(=O)N(CC(=O)N[C@@H](Cc3cnc[nH]3)C(=O)N3CCC[C@H]3C(=O)N[C@@H](Cc3ccccc3)C(O)=O)Cc2c1 Show InChI InChI=1S/C53H68N14O12/c1-29(2)45(65-47(73)38(10-6-18-58-53(55)56)63-46(72)36(54)24-44(70)71)49(75)60-33-14-17-37-32(22-33)26-66(50(76)39(61-37)20-31-12-15-35(68)16-13-31)27-43(69)62-40(23-34-25-57-28-59-34)51(77)67-19-7-11-42(67)48(74)64-41(52(78)79)21-30-8-4-3-5-9-30/h3-5,8-9,12-17,22,25,28-29,36,38-42,45,61,68H,6-7,10-11,18-21,23-24,26-27,54H2,1-2H3,(H,57,59)(H,60,75)(H,62,69)(H,63,72)(H,64,74)(H,65,73)(H,70,71)(H,78,79)(H4,55,56,58)/t36-,38-,39-,40-,41-,42-,45-/m0/s1 | PDB
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| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Binding affinity for Angiotensin II receptor type 2 using [125I]- Ang II in pig uterus myometrium |
J Med Chem 47: 859-70 (2004)
Article DOI: 10.1021/jm030921v
BindingDB Entry DOI: 10.7270/Q2736RNQ |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251488
(CHEMBL521093 | N-Butoxycarbonyl-3-[4-(N,N-diethylc...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)N(CC)CC Show InChI InChI=1S/C24H34N2O5S2/c1-6-9-14-31-24(28)25-33(29,30)23-21(16-20(32-23)15-17(4)5)18-10-12-19(13-11-18)22(27)26(7-2)8-3/h10-13,16-17H,6-9,14-15H2,1-5H3,(H,25,28) | PDB
Reactome pathway
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| 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251537
(CHEMBL479399 | butyl 5-isobutyl-3-(4-(piperidine-1...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)N1CCCCC1 Show InChI InChI=1S/C25H34N2O5S2/c1-4-5-15-32-25(29)26-34(30,31)24-22(17-21(33-24)16-18(2)3)19-9-11-20(12-10-19)23(28)27-13-7-6-8-14-27/h9-12,17-18H,4-8,13-16H2,1-3H3,(H,26,29) | PDB
Reactome pathway
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| 3.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50195698
((3S)-3-amino-3-{[(1S)-1-{[(2S)-2-[(2S)-butan-2-yl]...)Show SMILES CC[C@H](C)[C@@H]1Nc2c(Cc3ccc(O)cc3)cc(NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)cc2CN(CC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccccc2)C(O)=O)C1=O |wU:32.33,4.3,2.2,63.66,wD:21.29,46.47,59.63,(14.77,-5.6,;13.95,-6.91,;12.41,-6.86,;11.69,-5.5,;11.6,-8.16,;10.09,-7.83,;8.87,-8.79,;7.53,-8.02,;7.53,-6.48,;6.19,-5.71,;6.2,-4.17,;4.85,-3.41,;3.53,-4.18,;2.19,-3.41,;3.54,-5.73,;4.87,-6.49,;6.21,-8.79,;6.21,-10.32,;4.87,-11.09,;3.54,-10.32,;3.54,-8.78,;2.2,-11.09,;2.2,-12.63,;3.54,-13.4,;3.54,-14.94,;4.87,-15.71,;4.87,-17.25,;6.21,-18.02,;3.54,-18.02,;.87,-10.32,;-.46,-11.09,;-.46,-12.63,;-1.8,-10.32,;-3.13,-11.09,;-1.8,-8.78,;-3.13,-8.01,;-4.46,-8.78,;-3.13,-6.47,;7.54,-11.1,;8.87,-10.33,;10.08,-11.31,;11.6,-10.96,;12.55,-12.16,;14.09,-12.11,;14.92,-13.39,;14.81,-10.72,;16.34,-10.65,;17.53,-11.64,;17.47,-13.18,;18.76,-14.05,;18.26,-15.53,;16.72,-15.53,;16.25,-14.07,;17.09,-9.31,;16.31,-8,;18.62,-9.3,;19.15,-10.73,;20.69,-10.73,;21.12,-9.23,;19.81,-8.37,;19.05,-7.02,;17.51,-7,;19.83,-5.69,;19.11,-4.35,;17.56,-4.3,;16.83,-2.94,;17.63,-1.63,;16.91,-.28,;15.37,-.23,;14.55,-1.54,;15.29,-2.89,;19.9,-3.03,;19.17,-1.68,;21.45,-3.07,;12.27,-9.56,;13.81,-9.56,)| Show InChI InChI=1S/C52H67N13O11/c1-3-29(2)44-50(74)64(27-42(67)60-39(23-35-25-56-28-58-35)49(73)65-18-8-12-41(65)48(72)62-40(51(75)76)20-30-9-5-4-6-10-30)26-33-22-34(21-32(45(33)63-44)19-31-13-15-36(66)16-14-31)59-47(71)38(11-7-17-57-52(54)55)61-46(70)37(53)24-43(68)69/h4-6,9-10,13-16,21-22,25,28-29,37-41,44,63,66H,3,7-8,11-12,17-20,23-24,26-27,53H2,1-2H3,(H,56,58)(H,59,71)(H,60,67)(H,61,70)(H,62,72)(H,68,69)(H,75,76)(H4,54,55,57)/t29-,37-,38-,39-,40-,41-,44-/m0/s1 | PDB
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PubMed
| 4.70 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]Ang2 from AT2 receptor in pig uterus myometrium |
J Med Chem 49: 6133-7 (2006)
Article DOI: 10.1021/jm051222g
BindingDB Entry DOI: 10.7270/Q28P619Q |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251513
(CHEMBL520421 | butyl 3-(4-(cyclohexylcarbamoyl)phe...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)NC1CCCCC1 Show InChI InChI=1S/C26H36N2O5S2/c1-4-5-15-33-26(30)28-35(31,32)25-23(17-22(34-25)16-18(2)3)19-11-13-20(14-12-19)24(29)27-21-9-7-6-8-10-21/h11-14,17-18,21H,4-10,15-16H2,1-3H3,(H,27,29)(H,28,30) | PDB
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| 6.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251536
(CHEMBL517685 | butyl 5-isobutyl-3-(4-(pyrrolidine-...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)N1CCCC1 Show InChI InChI=1S/C24H32N2O5S2/c1-4-5-14-31-24(28)25-33(29,30)23-21(16-20(32-23)15-17(2)3)18-8-10-19(11-9-18)22(27)26-12-6-7-13-26/h8-11,16-17H,4-7,12-15H2,1-3H3,(H,25,28) | PDB
Reactome pathway
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| 6.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50221297
(CHEMBL239393 | N-butyloxycarbonyl-3-[4-(N,N-dimeth...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(CC(=O)N(C)C)cc1 Show InChI InChI=1S/C23H32N2O5S2/c1-6-7-12-30-23(27)24-32(28,29)22-20(15-19(31-22)13-16(2)3)18-10-8-17(9-11-18)14-21(26)25(4)5/h8-11,15-16H,6-7,12-14H2,1-5H3,(H,24,27) | PDB
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| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50221309
(CHEMBL246255 | N-butyloxycarbonyl-3-[4-(N-acetyl-N...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(CN(C)C(C)=O)cc1 Show InChI InChI=1S/C23H32N2O5S2/c1-6-7-12-30-23(27)24-32(28,29)22-21(14-20(31-22)13-16(2)3)19-10-8-18(9-11-19)15-25(5)17(4)26/h8-11,14,16H,6-7,12-13,15H2,1-5H3,(H,24,27) | PDB
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| 8.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50168423
((3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(2S)-4-({[(2S)-...)Show SMILES CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(O)=O)C(=O)Nc1cccc2CN(CC(=O)N[C@@H](Cc3cnc[nH]3)C(=O)N3CCC[C@H]3C(=O)N[C@@H](Cc3ccccc3)C(O)=O)C(=O)[C@H](Cc3ccc(O)cc3)Nc12 Show InChI InChI=1S/C50H61N11O12/c1-27(2)42(59-44(66)28(3)54-45(67)34(51)22-41(64)65)47(69)57-35-12-7-11-31-24-60(48(70)36(56-43(31)35)19-30-14-16-33(62)17-15-30)25-40(63)55-37(21-32-23-52-26-53-32)49(71)61-18-8-13-39(61)46(68)58-38(50(72)73)20-29-9-5-4-6-10-29/h4-7,9-12,14-17,23,26-28,34,36-39,42,56,62H,8,13,18-22,24-25,51H2,1-3H3,(H,52,53)(H,54,67)(H,55,63)(H,57,69)(H,58,68)(H,59,66)(H,64,65)(H,72,73)/t28-,34-,36-,37-,38-,39-,42-/m0/s1 | PDB
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| 9.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus myometrium |
J Med Chem 48: 4009-24 (2005)
Article DOI: 10.1021/jm0491492
BindingDB Entry DOI: 10.7270/Q2BR8SZD |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251490
(CHEMBL519274 | butyl 3-(4-(cyclopropylcarbamoyl)ph...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)NC1CC1 Show InChI InChI=1S/C23H30N2O5S2/c1-4-5-12-30-23(27)25-32(28,29)22-20(14-19(31-22)13-15(2)3)16-6-8-17(9-7-16)21(26)24-18-10-11-18/h6-9,14-15,18H,4-5,10-13H2,1-3H3,(H,24,26)(H,25,27) | PDB
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| 10.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251516
(CHEMBL480341 | butyl 5-isobutyl-3-(4-(thiazol-2-yl...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)Nc1nccs1 Show InChI InChI=1S/C23H27N3O5S3/c1-4-5-11-31-23(28)26-34(29,30)21-19(14-18(33-21)13-15(2)3)16-6-8-17(9-7-16)20(27)25-22-24-10-12-32-22/h6-10,12,14-15H,4-5,11,13H2,1-3H3,(H,26,28)(H,24,25,27) | PDB
Reactome pathway
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| 10.9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251515
(CHEMBL480340 | butyl 3-(4-(benzyl(methyl)carbamoyl...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)N(C)Cc1ccccc1 Show InChI InChI=1S/C28H34N2O5S2/c1-5-6-16-35-28(32)29-37(33,34)27-25(18-24(36-27)17-20(2)3)22-12-14-23(15-13-22)26(31)30(4)19-21-10-8-7-9-11-21/h7-15,18,20H,5-6,16-17,19H2,1-4H3,(H,29,32) | PDB
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| 31.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251487
(CHEMBL481088 | butyl 3-(4-(dimethylcarbamoyl)pheny...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)N(C)C Show InChI InChI=1S/C22H30N2O5S2/c1-6-7-12-29-22(26)23-31(27,28)21-19(14-18(30-21)13-15(2)3)16-8-10-17(11-9-16)20(25)24(4)5/h8-11,14-15H,6-7,12-13H2,1-5H3,(H,23,26) | PDB
Reactome pathway
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| 36.9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50168425
((3S)-3-amino-3-{[(1S)-1-{[(2S)-4-({[(2S)-1-[(2S)-2...)Show SMILES C[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)Nc1cccc2CN(CC(=O)N[C@@H](Cc3cnc[nH]3)C(=O)N3CCC[C@H]3C(=O)N[C@@H](Cc3ccccc3)C(O)=O)C(=O)[C@H](Cc3ccc(O)cc3)Nc12 Show InChI InChI=1S/C45H52N10O11/c1-25(49-41(61)31(46)20-38(58)59)40(60)52-32-10-5-9-28-22-54(43(63)33(51-39(28)32)17-27-12-14-30(56)15-13-27)23-37(57)50-34(19-29-21-47-24-48-29)44(64)55-16-6-11-36(55)42(62)53-35(45(65)66)18-26-7-3-2-4-8-26/h2-5,7-10,12-15,21,24-25,31,33-36,51,56H,6,11,16-20,22-23,46H2,1H3,(H,47,48)(H,49,61)(H,50,57)(H,52,60)(H,53,62)(H,58,59)(H,65,66)/t25-,31-,33-,34-,35-,36-/m0/s1 | PDB
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PubMed
| 37.4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]-Ang II from angiotensin II receptor type 2 in pig uterus myometrium |
J Med Chem 48: 4009-24 (2005)
Article DOI: 10.1021/jm0491492
BindingDB Entry DOI: 10.7270/Q2BR8SZD |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251608
(CHEMBL480122 | N-Butoxycarbonyl-2-[4-(N,N-diethylc...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1ccc(cc1-c1ccc(cc1)C(=O)N(CC)CC)-c1ccccc1 Show InChI InChI=1S/C28H32N2O5S/c1-4-7-19-35-28(32)29-36(33,34)26-18-17-24(21-11-9-8-10-12-21)20-25(26)22-13-15-23(16-14-22)27(31)30(5-2)6-3/h8-18,20H,4-7,19H2,1-3H3,(H,29,32) | PDB
Reactome pathway
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| 52 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50195696
((3S)-3-amino-3-{[(1S)-1-{[(2S)-2-[(2S)-butan-2-yl]...)Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@@H]-1-[#7]-c2c(-[#6]-c3ccc(-[#8])cc3)cc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6](-[#8])=O)cc2-[#6]-[#7](-[#6]-[#6](=O)-[#7]-2-[#6]-[#6]-[#6]-[#6@H]-2-[#6](=O)-[#7]-[#6@@H](-[#6]-c2ccccc2)-[#6](-[#8])=O)-[#6]-1=O Show InChI InChI=1S/C46H60N10O10/c1-3-26(2)39-44(64)55(25-37(58)56-18-8-12-36(56)43(63)53-35(45(65)66)20-27-9-5-4-6-10-27)24-30-22-31(21-29(40(30)54-39)19-28-13-15-32(57)16-14-28)51-42(62)34(11-7-17-50-46(48)49)52-41(61)33(47)23-38(59)60/h4-6,9-10,13-16,21-22,26,33-36,39,54,57H,3,7-8,11-12,17-20,23-25,47H2,1-2H3,(H,51,62)(H,52,61)(H,53,63)(H,59,60)(H,65,66)(H4,48,49,50)/t26-,33-,34-,35-,36-,39-/m0/s1 | PDB
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| 53.1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125I]Ang2 from AT2 receptor in pig uterus myometrium |
J Med Chem 49: 6133-7 (2006)
Article DOI: 10.1021/jm051222g
BindingDB Entry DOI: 10.7270/Q28P619Q |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50369331
(CHEMBL1791259)Show SMILES CC[C@@H](C)[C@H](N1Cc2cc(NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)ccc2[C@@H](Cc2ccc(O)cc2)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |wU:60.65,47.49,33.34,24.24,2.2,wD:4.4,13.20,64.68,(17.94,-9.01,;17.96,-7.5,;16.62,-6.73,;15.26,-7.47,;16.62,-5.23,;15.3,-4.47,;13.9,-5.27,;12.5,-4.49,;11.12,-5.27,;9.72,-4.51,;8.33,-5.29,;6.92,-4.54,;6.9,-2.96,;5.54,-5.34,;5.54,-6.9,;6.95,-7.69,;6.97,-9.26,;8.38,-10.03,;8.39,-11.61,;7,-12.41,;9.8,-12.38,;4.12,-4.56,;2.74,-5.36,;2.75,-6.94,;1.32,-4.59,;-.07,-5.39,;1.3,-3.01,;-.1,-2.24,;-1.5,-3.03,;-.12,-.67,;9.7,-2.93,;11.09,-2.13,;12.48,-2.91,;13.87,-2.11,;13.86,-.6,;12.51,.17,;12.5,1.68,;11.16,2.42,;9.82,1.65,;8.46,2.41,;9.85,.12,;11.18,-.62,;15.28,-2.89,;16.62,-2.12,;17.96,-4.47,;17.96,-2.98,;19.3,-5.23,;20.62,-4.47,;20.62,-2.98,;21.33,-1.86,;22.67,-1.76,;22.99,-.48,;21.83,.21,;20.81,-.64,;21.96,-5.23,;21.96,-6.72,;23.29,-4.45,;22.15,-3.46,;22.77,-2.11,;24.31,-2.24,;24.63,-3.7,;26.05,-4.31,;26.22,-5.8,;27.28,-3.42,;28.69,-4.03,;28.85,-5.51,;29.94,-6.58,;29.54,-8.02,;30.61,-9.08,;32.1,-8.69,;32.5,-7.25,;31.4,-6.18,;29.93,-3.13,;31.35,-3.73,;29.74,-1.65,)| Show InChI InChI=1S/C52H66N12O11/c1-3-29(2)44(48(71)61-40(24-34-26-56-28-58-34)50(73)63-20-8-12-42(63)47(70)62-41(51(74)75)22-30-9-5-4-6-10-30)64-27-32-23-33(15-18-36(32)37(49(64)72)21-31-13-16-35(65)17-14-31)59-46(69)39(11-7-19-57-52(54)55)60-45(68)38(53)25-43(66)67/h4-6,9-10,13-18,23,26,28-29,37-42,44,65H,3,7-8,11-12,19-22,24-25,27,53H2,1-2H3,(H,56,58)(H,59,69)(H,60,68)(H,61,71)(H,62,70)(H,66,67)(H,74,75)(H4,54,55,57)/t29-,37-,38+,39+,40+,41+,42+,44+/m1/s1 | PDB
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| 61 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Binding affinity for Angiotensin II receptor type 2 using [125I]- Ang II in pig uterus myometrium |
J Med Chem 47: 859-70 (2004)
Article DOI: 10.1021/jm030921v
BindingDB Entry DOI: 10.7270/Q2736RNQ |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251609
(CHEMBL479367 | butyl N-({2-[4-(diethylcarbamoyl)ph...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1ccc(Oc2ccccc2)cc1-c1ccc(cc1)C(=O)N(CC)CC Show InChI InChI=1S/C28H32N2O6S/c1-4-7-19-35-28(32)29-37(33,34)26-18-17-24(36-23-11-9-8-10-12-23)20-25(26)21-13-15-22(16-14-21)27(31)30(5-2)6-3/h8-18,20H,4-7,19H2,1-3H3,(H,29,32) | PDB
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| 91.7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251464
(CHEMBL518157 | butyl 3-(4-carbamoylphenyl)-5-isobu...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(N)=O Show InChI InChI=1S/C20H26N2O5S2/c1-4-5-10-27-20(24)22-29(25,26)19-17(12-16(28-19)11-13(2)3)14-6-8-15(9-7-14)18(21)23/h6-9,12-13H,4-5,10-11H2,1-3H3,(H2,21,23)(H,22,24) | PDB
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| 106 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251567
(CHEMBL511490 | butyl N-({2-[4-(diethylcarbamoyl)ph...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1cc(CC(C)C)ccc1-c1ccc(cc1)C(=O)N(CC)CC Show InChI InChI=1S/C26H36N2O5S/c1-6-9-16-33-26(30)27-34(31,32)24-18-20(17-19(4)5)10-15-23(24)21-11-13-22(14-12-21)25(29)28(7-2)8-3/h10-15,18-19H,6-9,16-17H2,1-5H3,(H,27,30) | PDB
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| 122 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251539
(CHEMBL481294 | butyl N-({2-[4-(diethylcarbamoyl)ph...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1ccc(CC(C)C)cc1-c1ccc(cc1)C(=O)N(CC)CC Show InChI InChI=1S/C26H36N2O5S/c1-6-9-16-33-26(30)27-34(31,32)24-15-10-20(17-19(4)5)18-23(24)21-11-13-22(14-12-21)25(29)28(7-2)8-3/h10-15,18-19H,6-9,16-17H2,1-5H3,(H,27,30) | PDB
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| 145 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251568
(CHEMBL481664 | butyl N-({4-benzyl-2-[4-(diethylcar...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1ccc(Cc2ccccc2)cc1-c1ccc(cc1)C(=O)N(CC)CC Show InChI InChI=1S/C29H34N2O5S/c1-4-7-19-36-29(33)30-37(34,35)27-18-13-23(20-22-11-9-8-10-12-22)21-26(27)24-14-16-25(17-15-24)28(32)31(5-2)6-3/h8-18,21H,4-7,19-20H2,1-3H3,(H,30,33) | PDB
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| 163 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251569
(CHEMBL480506 | butyl N-({5-benzyl-2-[4-(diethylcar...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1cc(Cc2ccccc2)ccc1-c1ccc(cc1)C(=O)N(CC)CC Show InChI InChI=1S/C29H34N2O5S/c1-4-7-19-36-29(33)30-37(34,35)27-21-23(20-22-11-9-8-10-12-22)13-18-26(27)24-14-16-25(17-15-24)28(32)31(5-2)6-3/h8-18,21H,4-7,19-20H2,1-3H3,(H,30,33) | PDB
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| 300 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251538
(CHEMBL481106 | butyl 5-isobutyl-3-(4-(morpholine-4...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)N1CCOCC1 Show InChI InChI=1S/C24H32N2O6S2/c1-4-5-12-32-24(28)25-34(29,30)23-21(16-20(33-23)15-17(2)3)18-6-8-19(9-7-18)22(27)26-10-13-31-14-11-26/h6-9,16-17H,4-5,10-15H2,1-3H3,(H,25,28) | PDB
Reactome pathway
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| 348 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Sus scrofa) | BDBM50251570
(CHEMBL480507 | butyl N-({2-[4-(diethylcarbamoyl)ph...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1ccccc1-c1ccc(cc1)C(=O)N(CC)CC Show InChI InChI=1S/C22H28N2O5S/c1-4-7-16-29-22(26)23-30(27,28)20-11-9-8-10-19(20)17-12-14-18(15-13-17)21(25)24(5-2)6-3/h8-15H,4-7,16H2,1-3H3,(H,23,26) | PDB
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| 402 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT2 receptor in pig uterus membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor A
(RAT) | BDBM50251538
(CHEMBL481106 | butyl 5-isobutyl-3-(4-(morpholine-4...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(cc1)C(=O)N1CCOCC1 Show InChI InChI=1S/C24H32N2O6S2/c1-4-5-12-32-24(28)25-34(29,30)23-21(16-20(33-23)15-17(2)3)18-6-8-19(9-7-18)22(27)26-10-13-31-14-11-26/h6-9,16-17H,4-5,10-15H2,1-3H3,(H,25,28) | PDB
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| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT1 receptor in rat liver membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50139788
(Angiotensin II analogue | CHEMBL415394)Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)Nc1ccc2N[C@@H](Cc3cnc[nH]3)C(=O)N(CC(=O)N[C@@H](Cc3ccccc3)C(O)=O)Cc2c1 Show InChI InChI=1S/C48H61N13O11/c1-26(2)41(60-43(67)35(9-6-16-53-48(50)51)58-42(66)33(49)21-40(64)65)45(69)59-36(17-28-10-13-32(62)14-11-28)44(68)55-30-12-15-34-29(19-30)23-61(46(70)37(56-34)20-31-22-52-25-54-31)24-39(63)57-38(47(71)72)18-27-7-4-3-5-8-27/h3-5,7-8,10-15,19,22,25-26,33,35-38,41,56,62H,6,9,16-18,20-21,23-24,49H2,1-2H3,(H,52,54)(H,55,68)(H,57,63)(H,58,66)(H,59,69)(H,60,67)(H,64,65)(H,71,72)(H4,50,51,53)/t33-,35-,36-,37-,38-,41-/m0/s1 | PDB
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| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Binding affinity for Angiotensin II receptor type 2 using [125I]- Ang II in pig uterus myometrium |
J Med Chem 47: 859-70 (2004)
Article DOI: 10.1021/jm030921v
BindingDB Entry DOI: 10.7270/Q2736RNQ |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50139784
(Angiotensin II analogue | CHEMBL386257)Show SMILES N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)Nc1ccc2N[C@@H](Cc3ccc(O)cc3)C(=O)N(CC(=O)N[C@@H](Cc3cnc[nH]3)C(=O)N3CCC[C@H]3C(=O)N[C@@H](Cc3ccccc3)C(O)=O)Cc2c1 Show InChI InChI=1S/C48H59N13O11/c49-33(22-41(64)65)42(66)58-35(8-4-16-53-48(50)51)43(67)55-30-12-15-34-29(20-30)24-60(45(69)36(56-34)18-28-10-13-32(62)14-11-28)25-40(63)57-37(21-31-23-52-26-54-31)46(70)61-17-5-9-39(61)44(68)59-38(47(71)72)19-27-6-2-1-3-7-27/h1-3,6-7,10-15,20,23,26,33,35-39,56,62H,4-5,8-9,16-19,21-22,24-25,49H2,(H,52,54)(H,55,67)(H,57,63)(H,58,66)(H,59,68)(H,64,65)(H,71,72)(H4,50,51,53)/t33-,35-,36-,37-,38-,39-/m0/s1 | PDB
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PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Binding affinity for Angiotensin II receptor type 2 using [125I]- Ang II in pig uterus myometrium |
J Med Chem 47: 859-70 (2004)
Article DOI: 10.1021/jm030921v
BindingDB Entry DOI: 10.7270/Q2736RNQ |
More data for this
Ligand-Target Pair | |
Type-2 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50369331
(CHEMBL1791259)Show SMILES CC[C@@H](C)[C@H](N1Cc2cc(NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)ccc2[C@@H](Cc2ccc(O)cc2)C1=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |wU:60.65,47.49,33.34,24.24,2.2,wD:4.4,13.20,64.68,(17.94,-9.01,;17.96,-7.5,;16.62,-6.73,;15.26,-7.47,;16.62,-5.23,;15.3,-4.47,;13.9,-5.27,;12.5,-4.49,;11.12,-5.27,;9.72,-4.51,;8.33,-5.29,;6.92,-4.54,;6.9,-2.96,;5.54,-5.34,;5.54,-6.9,;6.95,-7.69,;6.97,-9.26,;8.38,-10.03,;8.39,-11.61,;7,-12.41,;9.8,-12.38,;4.12,-4.56,;2.74,-5.36,;2.75,-6.94,;1.32,-4.59,;-.07,-5.39,;1.3,-3.01,;-.1,-2.24,;-1.5,-3.03,;-.12,-.67,;9.7,-2.93,;11.09,-2.13,;12.48,-2.91,;13.87,-2.11,;13.86,-.6,;12.51,.17,;12.5,1.68,;11.16,2.42,;9.82,1.65,;8.46,2.41,;9.85,.12,;11.18,-.62,;15.28,-2.89,;16.62,-2.12,;17.96,-4.47,;17.96,-2.98,;19.3,-5.23,;20.62,-4.47,;20.62,-2.98,;21.33,-1.86,;22.67,-1.76,;22.99,-.48,;21.83,.21,;20.81,-.64,;21.96,-5.23,;21.96,-6.72,;23.29,-4.45,;22.15,-3.46,;22.77,-2.11,;24.31,-2.24,;24.63,-3.7,;26.05,-4.31,;26.22,-5.8,;27.28,-3.42,;28.69,-4.03,;28.85,-5.51,;29.94,-6.58,;29.54,-8.02,;30.61,-9.08,;32.1,-8.69,;32.5,-7.25,;31.4,-6.18,;29.93,-3.13,;31.35,-3.73,;29.74,-1.65,)| Show InChI InChI=1S/C52H66N12O11/c1-3-29(2)44(48(71)61-40(24-34-26-56-28-58-34)50(73)63-20-8-12-42(63)47(70)62-41(51(74)75)22-30-9-5-4-6-10-30)64-27-32-23-33(15-18-36(32)37(49(64)72)21-31-13-16-35(65)17-14-31)59-46(69)39(11-7-19-57-52(54)55)60-45(68)38(53)25-43(66)67/h4-6,9-10,13-18,23,26,28-29,37-42,44,65H,3,7-8,11-12,19-22,24-25,27,53H2,1-2H3,(H,56,58)(H,59,69)(H,60,68)(H,61,71)(H,62,70)(H,66,67)(H,74,75)(H4,54,55,57)/t29-,37-,38+,39+,40+,41+,42+,44+/m1/s1 | PDB
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| CHEMBL
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PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Binding affinity for Angiotensin II receptor type 2 using [125I]- Ang II in pig uterus myometrium |
J Med Chem 47: 859-70 (2004)
Article DOI: 10.1021/jm030921v
BindingDB Entry DOI: 10.7270/Q2736RNQ |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor A
(RAT) | BDBM50156173
((1-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-...)Show SMILES CCCCOC(=O)NS(=O)(=O)c1sc(CC(C)C)cc1-c1ccc(Cn2ccnc2)cc1 Show InChI InChI=1S/C23H29N3O4S2/c1-4-5-12-30-23(27)25-32(28,29)22-21(14-20(31-22)13-17(2)3)19-8-6-18(7-9-19)15-26-11-10-24-16-26/h6-11,14,16-17H,4-5,12-13,15H2,1-3H3,(H,25,27) | PDB
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UniProtKB/SwissProt
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| Purchase
CHEMBL
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PC cid
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UniChem
Similars
| Article
PubMed
| >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University
Curated by ChEMBL
| Assay Description
Displacement of [125]Ang2 from AT1 receptor in rat liver membrane |
Bioorg Med Chem 16: 6841-9 (2008)
Article DOI: 10.1016/j.bmc.2008.05.066
BindingDB Entry DOI: 10.7270/Q22F7N7C |
More data for this
Ligand-Target Pair | |
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