Found 15 hits of kd data for polymerid = 50004685,5550 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-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50580361
(CHEMBL5075338)Show SMILES CCOC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)[C@@H](CC1CCCCC1)NC(=O)[C@@H](C)NC(=O)\C=C\c1ccc(O)c(O)c1 |r| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 0.490 | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Binding affinity to AT1R (unknown origin) expressed in Escherichia coli strain BL 21 (DE3) incubated for 20 mins by SDS PAGE analysis |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c00123
BindingDB Entry DOI: 10.7270/Q2ZP49Z0 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50052101
(2-({1-[2-{2-[2-{2-[5-Guanidino-2-(2-methylamino-ac...)Show SMILES CNCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)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/C48H69N13O10/c1-27(2)39(59-41(64)33(55-38(63)25-51-5)13-9-19-53-48(49)50)44(67)56-34(21-30-15-17-32(62)18-16-30)42(65)60-40(28(3)4)45(68)57-35(23-31-24-52-26-54-31)46(69)61-20-10-14-37(61)43(66)58-36(47(70)71)22-29-11-7-6-8-12-29/h6-8,11-12,15-18,24,26-28,33-37,39-40,51,62H,9-10,13-14,19-23,25H2,1-5H3,(H,52,54)(H,55,63)(H,56,67)(H,57,68)(H,58,66)(H,59,64)(H,60,65)(H,70,71)(H4,49,50,53)/t33-,34-,35-,36-,37+,39-,40-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 0.540 | n/a | n/a | n/a | n/a | n/a |
Washington University
Curated by ChEMBL
| Assay Description
Binding affinity was determined against Angiotensin II receptor, type 1 |
J Med Chem 39: 2738-44 (1996)
Article DOI: 10.1021/jm9507744
BindingDB Entry DOI: 10.7270/Q2S18345 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50159215
(CHEMBL3787375)Show SMILES OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.OC(=O)C(F)(F)F.[3H]CC([3H])C(=O)NCCCCNC(=O)\N=C(/N)NCCC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r| Show InChI InChI=1S/C58H85N15O14.3C2HF3O2/c1-6-34(5)48(54(83)68-42(29-37-31-61-32-65-37)55(84)73-26-14-18-44(73)52(81)69-43(56(85)86)28-35-15-9-8-10-16-35)71-51(80)41(27-36-19-21-38(74)22-20-36)67-53(82)47(33(3)4)70-50(79)40(66-49(78)39(59)30-46(76)77)17-13-25-63-57(60)72-58(87)64-24-12-11-23-62-45(75)7-2;3*3-2(4,5)1(6)7/h8-10,15-16,19-22,31-34,39-44,47-48,74H,6-7,11-14,17-18,23-30,59H2,1-5H3,(H,61,65)(H,62,75)(H,66,78)(H,67,82)(H,68,83)(H,69,81)(H,70,79)(H,71,80)(H,76,77)(H,85,86)(H4,60,63,64,72,87);3*(H,6,7)/t34-,39-,40-,41-,42-,43-,44-,47-,48-;;;/m0.../s1/i2T,7T;;;/t7?,34-,39-,40-,41-,42-,43-,44-,47-,48-;;; | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 0.930 | n/a | n/a | n/a | n/a | n/a |
University of Regensburg
Curated by ChEMBL
| Assay Description
Binding affinity to human AT1 receptor transfected in CHO cells co-expressing Galpha16-mtAEQ after 2 hrs by liquid scintillation counting |
J Med Chem 59: 1925-45 (2016)
Article DOI: 10.1021/acs.jmedchem.5b01495
BindingDB Entry DOI: 10.7270/Q2V69MGK |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50048128
(Asp-Arg-Val-Tyr-Val-His-Pro-Phe (Angiotensin II) |...)Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,wU:18.18,3.3,46.46,63.65,wD:7.14,27.26,39.39,59.62,(35.46,.19,;34.15,-.62,;32.79,.12,;34.19,-2.16,;32.87,-2.96,;31.52,-2.23,;31.48,-.69,;30.21,-3.03,;30.25,-4.57,;31.6,-5.31,;31.64,-6.85,;33,-7.58,;33.04,-9.12,;31.73,-9.93,;34.39,-9.85,;28.85,-2.3,;27.54,-3.1,;27.58,-4.64,;26.19,-2.37,;24.87,-3.17,;26.15,-.84,;27.46,-.03,;28.81,-.76,;27.42,1.51,;35.54,-2.89,;35.58,-4.43,;36.86,-2.08,;38.21,-2.82,;38.25,-4.36,;39.6,-5.1,;40.9,-4.3,;42.26,-5.02,;42.3,-6.56,;43.66,-7.3,;40.99,-7.36,;39.64,-6.64,;39.52,-2.02,;39.48,-.47,;40.88,-2.75,;42.19,-1.94,;43.54,-2.68,;44.85,-1.88,;43.58,-4.21,;42.14,-.41,;40.79,.33,;43.46,.4,;43.42,1.94,;42.06,2.68,;42.02,4.22,;40.76,5.08,;41.19,6.56,;42.73,6.61,;43.25,5.16,;44.73,2.75,;44.69,4.29,;46.08,2.01,;46.29,.48,;47.8,.21,;48.53,1.56,;47.47,2.67,;47.75,4.19,;46.59,5.19,;49.23,4.63,;49.59,6.13,;48.47,7.18,;48.83,8.69,;50.3,9.14,;50.67,10.63,;49.55,11.68,;48.07,11.26,;47.71,9.75,;51.07,6.57,;51.42,8.07,;52.19,5.51,)| Show InChI InChI=1S/C49H69N13O12/c1-26(2)39(60-42(67)33(12-8-18-54-49(51)52)56-41(66)32(50)23-38(64)65)45(70)57-34(20-29-14-16-31(63)17-15-29)43(68)61-40(27(3)4)46(71)58-35(22-30-24-53-25-55-30)47(72)62-19-9-13-37(62)44(69)59-36(48(73)74)21-28-10-6-5-7-11-28/h5-7,10-11,14-17,24-27,32-37,39-40,63H,8-9,12-13,18-23,50H2,1-4H3,(H,53,55)(H,56,66)(H,57,70)(H,58,71)(H,59,69)(H,60,67)(H,61,68)(H,64,65)(H,73,74)(H4,51,52,54)/t32-,33-,34-,35-,36-,37-,39-,40-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.60 | n/a | n/a | n/a | n/a | n/a |
ShanghaiTech University
Curated by ChEMBL
| Assay Description
Binding affinity to human AT1 receptor |
J Med Chem 61: 9841-9878 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00435
BindingDB Entry DOI: 10.7270/Q2F76GX7 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50236697
(5-L-isoleucineangiotensin II | 5-isoleucine-angiot...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O |wU:4.4,47.47,60.63,35.36,20.21,wD:2.2,24.32,8.17,64.66,(24.13,1.24,;24.1,-.31,;25.42,-1.09,;26.77,-.35,;25.4,-2.63,;24.05,-3.38,;22.73,-2.59,;22.75,-1.05,;21.38,-3.34,;21.36,-4.88,;22.68,-5.66,;24.01,-4.93,;25.33,-5.71,;25.32,-7.24,;26.64,-8.05,;23.97,-8.01,;22.65,-7.22,;20.06,-2.55,;18.71,-3.29,;18.68,-4.83,;17.38,-2.5,;16.04,-3.25,;14.72,-2.46,;14.74,-.92,;13.37,-3.2,;13.34,-4.74,;14.66,-5.53,;14.64,-7.08,;15.96,-7.87,;15.93,-9.4,;14.59,-10.16,;17.25,-10.21,;12.05,-2.42,;10.69,-3.15,;10.67,-4.69,;9.37,-2.36,;8.03,-3.1,;9.4,-.82,;10.75,-.07,;12.07,-.88,;10.78,1.47,;17.41,-.96,;18.76,-.21,;16.1,-.17,;26.72,-3.43,;26.69,-4.97,;28.07,-2.68,;29.38,-3.48,;30.73,-2.73,;30.75,-1.19,;29.53,-.27,;30.03,1.18,;31.57,1.17,;32.02,-.31,;29.35,-5.02,;28.01,-5.76,;30.54,-5.79,;31.99,-5.25,;32.95,-6.46,;32.1,-7.74,;30.62,-7.33,;29.33,-8.36,;27.89,-7.82,;29.58,-9.88,;28.39,-10.86,;26.95,-10.32,;25.76,-11.3,;26.02,-12.81,;24.84,-13.79,;23.4,-13.26,;23.14,-11.74,;24.32,-10.75,;28.64,-12.38,;27.45,-13.36,;30.08,-12.92,)| Show InChI InChI=1S/C50H71N13O12/c1-5-28(4)41(47(72)59-36(23-31-25-54-26-56-31)48(73)63-20-10-14-38(63)45(70)60-37(49(74)75)22-29-11-7-6-8-12-29)62-44(69)35(21-30-15-17-32(64)18-16-30)58-46(71)40(27(2)3)61-43(68)34(13-9-19-55-50(52)53)57-42(67)33(51)24-39(65)66/h6-8,11-12,15-18,25-28,33-38,40-41,64H,5,9-10,13-14,19-24,51H2,1-4H3,(H,54,56)(H,57,67)(H,58,71)(H,59,72)(H,60,70)(H,61,68)(H,62,69)(H,65,66)(H,74,75)(H4,52,53,55)/t28-,33-,34-,35-,36-,37-,38-,40-,41-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
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| Purchase
CHEMBL
MMDB
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a |
Washington University
Curated by ChEMBL
| Assay Description
Binding affinity was determined against Angiotensin II receptor, type 1 |
J Med Chem 39: 2738-44 (1996)
Article DOI: 10.1021/jm9507744
BindingDB Entry DOI: 10.7270/Q2S18345 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Cavia porcellus) | BDBM50417811
(CHEMBL1668010)Show SMILES CCCc1nc2cc([nH]c2n1Cc1ccc(cc1)-c1ccccc1C([O-])=O)C(=O)OC Show InChI InChI=1S/C24H23N3O4/c1-3-6-21-25-19-13-20(24(30)31-2)26-22(19)27(21)14-15-9-11-16(12-10-15)17-7-4-5-8-18(17)23(28)29/h4-5,7-13,26H,3,6,14H2,1-2H3,(H,28,29)/p-1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 15.8 | n/a | n/a | n/a | n/a | n/a |
The M. S. University of Baroda
Curated by ChEMBL
| Assay Description
Antagonist activity at angiotensin AT1 receptor in guinea pig ileum |
Bioorg Med Chem 18: 8418-56 (2010)
Article DOI: 10.1016/j.bmc.2010.10.043
BindingDB Entry DOI: 10.7270/Q2H70G3T |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50052108
(CHEMBL415025 | Sar-Arg-Val-Tyr-Hcy-His-Mpc-Phe)Show SMILES CNCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CCSS[C@@H]2C[C@@H](N(C2)C(=O)[C@@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C47H65N13O10S2/c1-26(2)39(59-41(64)32(54-38(62)23-50-3)10-7-16-52-47(48)49)44(67)56-34(18-28-11-13-30(61)14-12-28)42(65)55-33-15-17-71-72-31-21-37(43(66)58-36(46(69)70)19-27-8-5-4-6-9-27)60(24-31)45(68)35(57-40(33)63)20-29-22-51-25-53-29/h4-6,8-9,11-14,22,25-26,31-37,39,50,61H,7,10,15-21,23-24H2,1-3H3,(H,51,53)(H,54,62)(H,55,65)(H,56,67)(H,57,63)(H,58,66)(H,59,64)(H,69,70)(H4,48,49,52)/t31-,32+,33-,34+,35-,36+,37-,39+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a |
Washington University
Curated by ChEMBL
| Assay Description
Binding affinity was determined against Angiotensin II receptor, type 1 |
J Med Chem 39: 2738-44 (1996)
Article DOI: 10.1021/jm9507744
BindingDB Entry DOI: 10.7270/Q2S18345 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50052102
(CHEMBL414918 | Sar-Arg-Val-D-Tyr-Pro-His-Pro-Phe)Show SMILES CNCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@@H]1C(=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/C48H67N13O10/c1-28(2)40(59-41(64)33(55-39(63)26-51-3)12-7-19-53-48(49)50)44(67)57-34(22-30-15-17-32(62)18-16-30)45(68)60-20-8-13-37(60)42(65)56-35(24-31-25-52-27-54-31)46(69)61-21-9-14-38(61)43(66)58-36(47(70)71)23-29-10-5-4-6-11-29/h4-6,10-11,15-18,25,27-28,33-38,40,51,62H,7-9,12-14,19-24,26H2,1-3H3,(H,52,54)(H,55,63)(H,56,65)(H,57,67)(H,58,66)(H,59,64)(H,70,71)(H4,49,50,53)/t33-,34+,35-,36-,37+,38+,40-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 58 | n/a | n/a | n/a | n/a | n/a |
Washington University
Curated by ChEMBL
| Assay Description
Binding affinity was determined against Angiotensin II receptor, type 1 |
J Med Chem 39: 2738-44 (1996)
Article DOI: 10.1021/jm9507744
BindingDB Entry DOI: 10.7270/Q2S18345 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50518054
(CHEMBL4517561)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC)C(C)C)[C@@H](C)CC)C(C)C)C(O)=O |r| Show InChI InChI=1S/C42H73N13O9/c1-10-24(7)33(53-38(60)32(23(5)6)51-35(57)27(49-30(56)20-45-9)14-12-16-47-42(43)44)39(61)52-31(22(3)4)37(59)50-28(18-26-19-46-21-48-26)40(62)55-17-13-15-29(55)36(58)54-34(41(63)64)25(8)11-2/h19,21-25,27-29,31-34,45H,10-18,20H2,1-9H3,(H,46,48)(H,49,56)(H,50,59)(H,51,57)(H,52,61)(H,53,60)(H,54,58)(H,63,64)(H4,43,44,47)/t24-,25-,27-,28-,29-,31-,32-,33-,34-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a |
ShanghaiTech University
Curated by ChEMBL
| Assay Description
Binding affinity to human AT1 receptor |
J Med Chem 61: 9841-9878 (2018)
Article DOI: 10.1021/acs.jmedchem.8b00435
BindingDB Entry DOI: 10.7270/Q2F76GX7 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50052110
(CHEMBL216678 | Sar-Arg-Val-Tyr-Hcy-His-Mpt-Phe)Show SMILES CNCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CCSS[C@@H]2C[C@H](N(C2)C(=O)[C@@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C47H65N13O10S2/c1-26(2)39(59-41(64)32(54-38(62)23-50-3)10-7-16-52-47(48)49)44(67)56-34(18-28-11-13-30(61)14-12-28)42(65)55-33-15-17-71-72-31-21-37(43(66)58-36(46(69)70)19-27-8-5-4-6-9-27)60(24-31)45(68)35(57-40(33)63)20-29-22-51-25-53-29/h4-6,8-9,11-14,22,25-26,31-37,39,50,61H,7,10,15-21,23-24H2,1-3H3,(H,51,53)(H,54,62)(H,55,65)(H,56,67)(H,57,63)(H,58,66)(H,59,64)(H,69,70)(H4,48,49,52)/t31-,32+,33-,34+,35-,36+,37+,39+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 750 | n/a | n/a | n/a | n/a | n/a |
Washington University
Curated by ChEMBL
| Assay Description
Binding affinity was determined against Angiotensin II receptor, type 1 |
J Med Chem 39: 2738-44 (1996)
Article DOI: 10.1021/jm9507744
BindingDB Entry DOI: 10.7270/Q2S18345 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50052106
(CHEMBL406170 | Sar-Arg-Val-Tyr-Cys-His-Mpc-Phe)Show SMILES CNCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CSS[C@@H]2C[C@@H](N(C2)C(=O)[C@@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C46H63N13O10S2/c1-25(2)38(58-39(62)31(53-37(61)21-49-3)10-7-15-51-46(47)48)43(66)54-32(16-27-11-13-29(60)14-12-27)40(63)57-35-23-70-71-30-19-36(42(65)56-34(45(68)69)17-26-8-5-4-6-9-26)59(22-30)44(67)33(55-41(35)64)18-28-20-50-24-52-28/h4-6,8-9,11-14,20,24-25,30-36,38,49,60H,7,10,15-19,21-23H2,1-3H3,(H,50,52)(H,53,61)(H,54,66)(H,55,64)(H,56,65)(H,57,63)(H,58,62)(H,68,69)(H4,47,48,51)/t30-,31+,32+,33-,34+,35-,36-,38+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a |
Washington University
Curated by ChEMBL
| Assay Description
Binding affinity was determined against Angiotensin II receptor, type 1 |
J Med Chem 39: 2738-44 (1996)
Article DOI: 10.1021/jm9507744
BindingDB Entry DOI: 10.7270/Q2S18345 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50052103
(CHEMBL217873 | Sar-Arg-Val-Tyr-Glu-His-Apt-Phe)Show SMILES CNCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CCC(=O)N[C@@H]2C[C@@H](N(C2)C(=O)[C@@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C48H66N14O11/c1-26(2)40(61-42(67)32(56-39(65)23-51-3)10-7-17-53-48(49)50)45(70)58-34(18-28-11-13-31(63)14-12-28)43(68)57-33-15-16-38(64)55-30-21-37(44(69)60-36(47(72)73)19-27-8-5-4-6-9-27)62(24-30)46(71)35(59-41(33)66)20-29-22-52-25-54-29/h4-6,8-9,11-14,22,25-26,30,32-37,40,51,63H,7,10,15-21,23-24H2,1-3H3,(H,52,54)(H,55,64)(H,56,65)(H,57,68)(H,58,70)(H,59,66)(H,60,69)(H,61,67)(H,72,73)(H4,49,50,53)/t30-,32+,33-,34-,35-,36-,37-,40+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a |
Washington University
Curated by ChEMBL
| Assay Description
Binding affinity was determined against Angiotensin II receptor, type 1 |
J Med Chem 39: 2738-44 (1996)
Article DOI: 10.1021/jm9507744
BindingDB Entry DOI: 10.7270/Q2S18345 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50052104
(CHEMBL410812 | Sar-Arg-Val-Tyr-Asp-His-Apt-Phe)Show SMILES CNCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CC(=O)N[C@@H]2C[C@@H](N(C2)C(=O)[C@@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C47H64N14O11/c1-25(2)39(60-40(65)31(55-38(64)22-50-3)10-7-15-52-47(48)49)44(69)57-32(16-27-11-13-30(62)14-12-27)41(66)56-33-20-37(63)54-29-19-36(43(68)59-35(46(71)72)17-26-8-5-4-6-9-26)61(23-29)45(70)34(58-42(33)67)18-28-21-51-24-53-28/h4-6,8-9,11-14,21,24-25,29,31-36,39,50,62H,7,10,15-20,22-23H2,1-3H3,(H,51,53)(H,54,63)(H,55,64)(H,56,66)(H,57,69)(H,58,67)(H,59,68)(H,60,65)(H,71,72)(H4,48,49,52)/t29-,31+,32+,33-,34-,35+,36-,39+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a |
Washington University
Curated by ChEMBL
| Assay Description
Binding affinity was determined against Angiotensin II receptor, type 1 |
J Med Chem 39: 2738-44 (1996)
Article DOI: 10.1021/jm9507744
BindingDB Entry DOI: 10.7270/Q2S18345 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50052105
(CHEMBL405938 | Sar-Arg-Val-Tyr-Cys-His-Pen-Phe)Show SMILES CNCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CSSC(C)(C)[C@@H](NC(=O)[C@@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C46H65N13O10S2/c1-25(2)36(58-38(62)30(53-35(61)22-49-5)12-9-17-51-45(47)48)42(66)55-31(18-27-13-15-29(60)16-14-27)39(63)57-34-23-70-71-46(3,4)37(43(67)56-33(44(68)69)19-26-10-7-6-8-11-26)59-40(64)32(54-41(34)65)20-28-21-50-24-52-28/h6-8,10-11,13-16,21,24-25,30-34,36-37,49,60H,9,12,17-20,22-23H2,1-5H3,(H,50,52)(H,53,61)(H,54,65)(H,55,66)(H,56,67)(H,57,63)(H,58,62)(H,59,64)(H,68,69)(H4,47,48,51)/t30-,31-,32+,33-,34+,36-,37-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a |
Washington University
Curated by ChEMBL
| Assay Description
Binding affinity was determined against Angiotensin II receptor, type 1 |
J Med Chem 39: 2738-44 (1996)
Article DOI: 10.1021/jm9507744
BindingDB Entry DOI: 10.7270/Q2S18345 |
More data for this
Ligand-Target Pair | |
Type-1 angiotensin II receptor
(Homo sapiens (Human)) | BDBM50052109
(CHEMBL412864 | Sar-Arg-Val-Tyr-Cys-His-Mpt-Phe)Show SMILES CNCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CSS[C@@H]2C[C@H](N(C2)C(=O)[C@@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C46H63N13O10S2/c1-25(2)38(58-39(62)31(53-37(61)21-49-3)10-7-15-51-46(47)48)43(66)54-32(16-27-11-13-29(60)14-12-27)40(63)57-35-23-70-71-30-19-36(42(65)56-34(45(68)69)17-26-8-5-4-6-9-26)59(22-30)44(67)33(55-41(35)64)18-28-20-50-24-52-28/h4-6,8-9,11-14,20,24-25,30-36,38,49,60H,7,10,15-19,21-23H2,1-3H3,(H,50,52)(H,53,61)(H,54,66)(H,55,64)(H,56,65)(H,57,63)(H,58,62)(H,68,69)(H4,47,48,51)/t30-,31+,32+,33-,34+,35-,36+,38+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a |
Washington University
Curated by ChEMBL
| Assay Description
Binding affinity was determined against Angiotensin II receptor, type 1 |
J Med Chem 39: 2738-44 (1996)
Article DOI: 10.1021/jm9507744
BindingDB Entry DOI: 10.7270/Q2S18345 |
More data for this
Ligand-Target Pair | |
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