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PubMed code 8246227

Compile data set for download or QSAR
Found 57 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042565
PNG
(5-Butyl-2-(2,6-dichloro-phenyl)-4-[2'-(1H-tetrazol...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1c(Cl)cccc1Cl |(-6.39,-5.83,;-4.86,-5.84,;-4.08,-4.52,;-2.54,-4.53,;-1.61,-3.29,;-2.1,-1.82,;-.85,-.9,;.39,-1.82,;1.86,-1.35,;2.18,.16,;3.35,-2.08,;-.08,-3.29,;.81,-4.53,;2.36,-4.52,;3.12,-5.86,;4.66,-5.84,;5.42,-4.52,;4.63,-3.2,;3.1,-3.2,;6.96,-4.5,;7.72,-5.84,;9.27,-5.84,;10.01,-4.5,;9.25,-3.16,;7.71,-3.16,;7.18,-1.7,;8.42,-.81,;7.94,.66,;6.41,.66,;5.94,-.81,;-1.26,.59,;-2.73,.98,;-3.86,-.07,;-3.12,2.44,;-2.04,3.56,;-.56,3.14,;-.16,1.68,;1.25,1.9,)|
Show InChI InChI=1S/C28H24Cl2N6O2/c1-2-3-11-24-21(25(28(37)38)36(33-24)26-22(29)9-6-10-23(26)30)16-17-12-14-18(15-13-17)19-7-4-5-8-20(19)27-31-34-35-32-27/h4-10,12-15H,2-3,11,16H2,1H3,(H,37,38)(H,31,32,34,35)
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n/an/a 0.180n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042571
PNG
(2-Benzyl-5-butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nn(Cc2ccccc2)c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C29H28N6O2/c1-2-3-13-26-25(27(29(36)37)35(32-26)19-21-9-5-4-6-10-21)18-20-14-16-22(17-15-20)23-11-7-8-12-24(23)28-30-33-34-31-28/h4-12,14-17H,2-3,13,18-19H2,1H3,(H,36,37)(H,30,31,33,34)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042578
PNG
(5-Butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C29H25F3N6O2/c1-2-3-11-24-22(26(28(39)40)38(35-24)25-12-7-6-10-23(25)29(30,31)32)17-18-13-15-19(16-14-18)20-8-4-5-9-21(20)27-33-36-37-34-27/h4-10,12-16H,2-3,11,17H2,1H3,(H,39,40)(H,33,34,36,37)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042570
PNG
(5-Butyl-2-phenethyl-4-[2'-(1H-tetrazol-5-yl)-biphe...)
Show SMILES CCCCc1nn(CCc2ccccc2)c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C30H30N6O2/c1-2-3-13-27-26(28(30(37)38)36(33-27)19-18-21-9-5-4-6-10-21)20-22-14-16-23(17-15-22)24-11-7-8-12-25(24)29-31-34-35-32-29/h4-12,14-17H,2-3,13,18-20H2,1H3,(H,37,38)(H,31,32,34,35)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042559
PNG
(5-Butyl-2-(2-chloro-phenyl)-4-[2'-(1H-tetrazol-5-y...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1Cl
Show InChI InChI=1S/C28H25ClN6O2/c1-2-3-11-24-22(26(28(36)37)35(32-24)25-12-7-6-10-23(25)29)17-18-13-15-19(16-14-18)20-8-4-5-9-21(20)27-30-33-34-31-27/h4-10,12-16H,2-3,11,17H2,1H3,(H,36,37)(H,30,31,33,34)
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Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042534
PNG
(2-Benzyl-5-propyl-4-[2'-(1H-tetrazol-5-yl)-bipheny...)
Show SMILES CCCc1nn(Cc2ccccc2)c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C28H26N6O2/c1-2-8-25-24(26(28(35)36)34(31-25)18-20-9-4-3-5-10-20)17-19-13-15-21(16-14-19)22-11-6-7-12-23(22)27-29-32-33-30-27/h3-7,9-16H,2,8,17-18H2,1H3,(H,35,36)(H,29,30,32,33)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042569
PNG
(5-Butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1C
Show InChI InChI=1S/C29H28N6O2/c1-3-4-12-25-24(27(29(36)37)35(32-25)26-13-8-5-9-19(26)2)18-20-14-16-21(17-15-20)22-10-6-7-11-23(22)28-30-33-34-31-28/h5-11,13-17H,3-4,12,18H2,1-2H3,(H,36,37)(H,30,31,33,34)
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Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042576
PNG
(5-Butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1c(Cl)cc(Cl)cc1Cl |(-2.96,-14.32,;-1.41,-14.32,;-.64,-13.02,;.92,-13.03,;1.82,-11.79,;1.36,-10.32,;2.6,-9.41,;3.84,-10.32,;5.31,-9.83,;5.63,-8.33,;6.79,-10.57,;3.37,-11.79,;4.27,-13.03,;5.81,-13.02,;6.57,-14.35,;8.11,-14.34,;8.86,-13.02,;8.09,-11.69,;6.56,-11.7,;10.41,-13,;11.18,-14.34,;12.71,-14.32,;13.48,-13,;12.69,-11.64,;11.16,-11.67,;10.63,-10.21,;11.87,-9.31,;11.4,-7.85,;9.86,-7.83,;9.38,-9.3,;2.2,-7.88,;3.31,-6.78,;4.76,-6.54,;2.91,-5.28,;1.4,-4.86,;.98,-3.34,;.29,-5.99,;.69,-7.47,;-.47,-8.57,)|
Show InChI InChI=1S/C28H23Cl3N6O2/c1-2-3-8-24-21(25(28(38)39)37(34-24)26-22(30)14-18(29)15-23(26)31)13-16-9-11-17(12-10-16)19-6-4-5-7-20(19)27-32-35-36-33-27/h4-7,9-12,14-15H,2-3,8,13H2,1H3,(H,38,39)(H,32,33,35,36)
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Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042538
PNG
(5-Butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)
Show SMILES CCCCc1nn(CC(F)(F)F)c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C24H23F3N6O2/c1-2-3-8-20-19(21(23(34)35)33(30-20)14-24(25,26)27)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-28-31-32-29-22/h4-7,9-12H,2-3,8,13-14H2,1H3,(H,34,35)(H,28,29,31,32)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042580
PNG
(2-Butyl-5-(2-chloro-phenyl)-3-[2'-(1H-tetrazol-5-y...)
Show SMILES CCCCc1nc(c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1Cl
Show InChI InChI=1S/C28H25ClN6O2/c1-2-3-12-24-30-25(22-10-6-7-11-23(22)29)26(28(36)37)35(24)17-18-13-15-19(16-14-18)20-8-4-5-9-21(20)27-31-33-34-32-27/h4-11,13-16H,2-3,12,17H2,1H3,(H,36,37)(H,31,32,33,34)
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Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042543
PNG
(5-Butyl-2-(2,4-dichloro-phenyl)-4-[2'-(1H-tetrazol...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C28H24Cl2N6O2/c1-2-3-8-24-22(26(28(37)38)36(33-24)25-14-13-19(29)16-23(25)30)15-17-9-11-18(12-10-17)20-6-4-5-7-21(20)27-31-34-35-32-27/h4-7,9-14,16H,2-3,8,15H2,1H3,(H,37,38)(H,31,32,34,35)
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Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042558
PNG
(2-Biphenyl-2-yl-5-butyl-4-[2'-(1H-tetrazol-5-yl)-b...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1-c1ccccc1
Show InChI InChI=1S/C34H30N6O2/c1-2-3-16-30-29(22-23-18-20-25(21-19-23)26-13-7-8-15-28(26)33-35-38-39-36-33)32(34(41)42)40(37-30)31-17-10-9-14-27(31)24-11-5-4-6-12-24/h4-15,17-21H,2-3,16,22H2,1H3,(H,41,42)(H,35,36,38,39)
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Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042551
PNG
(5-Propyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C28H23F3N6O2/c1-2-7-23-21(25(27(38)39)37(34-23)24-11-6-5-10-22(24)28(29,30)31)16-17-12-14-18(15-13-17)19-8-3-4-9-20(19)26-32-35-36-33-26/h3-6,8-15H,2,7,16H2,1H3,(H,38,39)(H,32,33,35,36)
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Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042550
PNG
(2-(2,6-Dichloro-phenyl)-5-propyl-4-[2'-(1H-tetrazo...)
Show SMILES CCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1c(Cl)cccc1Cl |(5.83,-9.45,;7.3,-8.97,;8.44,-10.01,;9.9,-9.53,;10.37,-8.06,;11.91,-8.06,;12.39,-9.53,;13.84,-10,;14.98,-8.97,;14.13,-11.23,;11.14,-10.44,;11.19,-12.68,;12.51,-13.44,;13.86,-12.67,;15.18,-13.44,;15.18,-14.98,;13.86,-15.74,;12.53,-14.98,;16.51,-15.74,;16.51,-17.29,;17.84,-18.05,;19.17,-17.29,;19.17,-15.74,;17.84,-14.97,;17.82,-13.44,;19.06,-12.54,;18.59,-11.07,;17.05,-11.08,;16.58,-12.54,;12.3,-6.57,;11.2,-5.5,;9.72,-5.91,;11.58,-4.01,;13.07,-3.59,;14.18,-4.68,;13.79,-6.17,;14.89,-7.25,)|
Show InChI InChI=1S/C27H22Cl2N6O2/c1-2-6-23-20(24(27(36)37)35(32-23)25-21(28)9-5-10-22(25)29)15-16-11-13-17(14-12-16)18-7-3-4-8-19(18)26-30-33-34-31-26/h3-5,7-14H,2,6,15H2,1H3,(H,36,37)(H,30,31,33,34)
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Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042542
PNG
(5-Butyl-2-(2,3-dichloro-phenyl)-4-[2'-(1H-tetrazol...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C28H24Cl2N6O2/c1-2-3-10-23-21(26(28(37)38)36(33-23)24-11-6-9-22(29)25(24)30)16-17-12-14-18(15-13-17)19-7-4-5-8-20(19)27-31-34-35-32-27/h4-9,11-15H,2-3,10,16H2,1H3,(H,37,38)(H,31,32,34,35)
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Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042537
PNG
(5-Butyl-2-(4-methoxy-phenyl)-4-[2'-(1H-tetrazol-5-...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(OC)cc1
Show InChI InChI=1S/C29H28N6O3/c1-3-4-9-26-25(27(29(36)37)35(32-26)21-14-16-22(38-2)17-15-21)18-19-10-12-20(13-11-19)23-7-5-6-8-24(23)28-30-33-34-31-28/h5-8,10-17H,3-4,9,18H2,1-2H3,(H,36,37)(H,30,31,33,34)
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Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM82428
PNG
(CAS_124750-95-4 | CB91356279 | CHEMBL443269 | DuP ...)
Show SMILES CCCc1nc(c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(F)(F)C(F)(F)F
Show InChI InChI=1S/C23H19F5N6O2/c1-2-5-17-29-19(22(24,25)23(26,27)28)18(21(35)36)34(17)12-13-8-10-14(11-9-13)15-6-3-4-7-16(15)20-30-32-33-31-20/h3-4,6-11H,2,5,12H2,1H3,(H,35,36)(H,30,31,32,33)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042556
PNG
(5-Butyl-2-(4-chloro-phenyl)-4-[2'-(1H-tetrazol-5-y...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C28H25ClN6O2/c1-2-3-8-25-24(26(28(36)37)35(32-25)21-15-13-20(29)14-16-21)17-18-9-11-19(12-10-18)22-6-4-5-7-23(22)27-30-33-34-31-27/h4-7,9-16H,2-3,8,17H2,1H3,(H,36,37)(H,30,31,33,34)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042573
PNG
(5-Propyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCCc1nn(CC(F)(F)F)c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C23H21F3N6O2/c1-2-5-19-18(20(22(33)34)32(29-19)13-23(24,25)26)12-14-8-10-15(11-9-14)16-6-3-4-7-17(16)21-27-30-31-28-21/h3-4,6-11H,2,5,12-13H2,1H3,(H,33,34)(H,27,28,30,31)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042575
PNG
(5-Butyl-2-pyridin-2-yl-4-[2'-(1H-tetrazol-5-yl)-bi...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccn1
Show InChI InChI=1S/C27H25N7O2/c1-2-3-10-23-22(25(27(35)36)34(31-23)24-11-6-7-16-28-24)17-18-12-14-19(15-13-18)20-8-4-5-9-21(20)26-29-32-33-30-26/h4-9,11-16H,2-3,10,17H2,1H3,(H,35,36)(H,29,30,32,33)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042544
PNG
(5-Butyl-2-(2-nitro-phenyl)-4-[2'-(1H-tetrazol-5-yl...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C28H25N7O4/c1-2-3-10-23-22(26(28(36)37)34(31-23)24-11-6-7-12-25(24)35(38)39)17-18-13-15-19(16-14-18)20-8-4-5-9-21(20)27-29-32-33-30-27/h4-9,11-16H,2-3,10,17H2,1H3,(H,36,37)(H,29,30,32,33)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042572
PNG
(5-Butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)
Show SMILES CCCCc1[nH]nc(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C22H22N6O2/c1-2-3-8-19-18(20(22(29)30)24-23-19)13-14-9-11-15(12-10-14)16-6-4-5-7-17(16)21-25-27-28-26-21/h4-7,9-12H,2-3,8,13H2,1H3,(H,23,24)(H,29,30)(H,25,26,27,28)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042582
PNG
(2-Butyl-5-phenyl-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc(c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1
Show InChI InChI=1S/C28H26N6O2/c1-2-3-13-24-29-25(21-9-5-4-6-10-21)26(28(35)36)34(24)18-19-14-16-20(17-15-19)22-11-7-8-12-23(22)27-30-32-33-31-27/h4-12,14-17H,2-3,13,18H2,1H3,(H,35,36)(H,30,31,32,33)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042535
PNG
(5-Butyl-2-(3-chloro-phenyl)-4-[2'-(1H-tetrazol-5-y...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cccc(Cl)c1
Show InChI InChI=1S/C28H25ClN6O2/c1-2-3-11-25-24(26(28(36)37)35(32-25)21-8-6-7-20(29)17-21)16-18-12-14-19(15-13-18)22-9-4-5-10-23(22)27-30-33-34-31-27/h4-10,12-15,17H,2-3,11,16H2,1H3,(H,36,37)(H,30,31,33,34)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042581
PNG
(5-Butyl-2-(4-methoxy-2-nitro-phenyl)-4-[2'-(1H-tet...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(OC)cc1[N+]([O-])=O
Show InChI InChI=1S/C29H27N7O5/c1-3-4-9-24-23(27(29(37)38)35(32-24)25-15-14-20(41-2)17-26(25)36(39)40)16-18-10-12-19(13-11-18)21-7-5-6-8-22(21)28-30-33-34-31-28/h5-8,10-15,17H,3-4,9,16H2,1-2H3,(H,37,38)(H,30,31,33,34)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042554
PNG
(5-Butyl-2-ethyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-...)
Show SMILES CCCCc1nn(CC)c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C24H26N6O2/c1-3-5-10-21-20(22(24(31)32)30(4-2)27-21)15-16-11-13-17(14-12-16)18-8-6-7-9-19(18)23-25-28-29-26-23/h6-9,11-14H,3-5,10,15H2,1-2H3,(H,31,32)(H,25,26,28,29)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50006909
PNG
(2-Butyl-5-chloro-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc(Cl)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C22H21ClN6O2/c1-2-3-8-18-24-20(23)19(22(30)31)29(18)13-14-9-11-15(12-10-14)16-6-4-5-7-17(16)21-25-27-28-26-21/h4-7,9-12H,2-3,8,13H2,1H3,(H,30,31)(H,25,26,27,28)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042555
PNG
(5-Butyl-2-phenyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1
Show InChI InChI=1S/C28H26N6O2/c1-2-3-13-25-24(26(28(35)36)34(31-25)21-9-5-4-6-10-21)18-19-14-16-20(17-15-19)22-11-7-8-12-23(22)27-29-32-33-30-27/h4-12,14-17H,2-3,13,18H2,1H3,(H,35,36)(H,29,30,32,33)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042577
PNG
(5-Butyl-2-(2,5-dichloro-phenyl)-4-[2'-(1H-tetrazol...)
Show SMILES CCCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C28H24Cl2N6O2/c1-2-3-8-24-22(26(28(37)38)36(33-24)25-16-19(29)13-14-23(25)30)15-17-9-11-18(12-10-17)20-6-4-5-7-21(20)27-31-34-35-32-27/h4-7,9-14,16H,2-3,8,15H2,1H3,(H,37,38)(H,31,32,34,35)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042536
PNG
(5-Propyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCCc1[nH]nc(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C21H20N6O2/c1-2-5-18-17(19(21(28)29)23-22-18)12-13-8-10-14(11-9-13)15-6-3-4-7-16(15)20-24-26-27-25-20/h3-4,6-11H,2,5,12H2,1H3,(H,22,23)(H,28,29)(H,24,25,26,27)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042539
PNG
(5-Cyclopropylmethyl-2-(2,6-dichloro-phenyl)-4-[2'-...)
Show SMILES OC(=O)c1c(Cc2ccc(cc2)-c2ccccc2-c2nnn[nH]2)c(CC2CC2)nn1-c1c(Cl)cccc1Cl |(14.99,-8.98,;13.85,-10.01,;14.15,-11.24,;12.4,-9.54,;11.15,-10.45,;11.19,-12.69,;12.52,-13.45,;13.87,-12.68,;15.2,-13.45,;15.2,-14.99,;13.88,-15.76,;12.54,-14.99,;16.52,-15.76,;16.52,-17.3,;17.85,-18.07,;19.19,-17.3,;19.19,-15.76,;17.85,-14.99,;17.84,-13.46,;19.07,-12.55,;18.61,-11.08,;17.07,-11.09,;16.59,-12.55,;9.91,-9.54,;8.44,-10.02,;7.3,-8.98,;6.84,-7.54,;5.8,-8.68,;10.38,-8.07,;11.92,-8.07,;12.31,-6.58,;11.21,-5.51,;9.73,-5.92,;11.59,-4.02,;13.08,-3.6,;14.19,-4.68,;13.81,-6.18,;14.9,-7.26,)|
Show InChI InChI=1S/C28H22Cl2N6O2/c29-22-6-3-7-23(30)26(22)36-25(28(37)38)21(24(33-36)15-17-8-9-17)14-16-10-12-18(13-11-16)19-4-1-2-5-20(19)27-31-34-35-32-27/h1-7,10-13,17H,8-9,14-15H2,(H,37,38)(H,31,32,34,35)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042568
PNG
(5-Butyl-2-(2,4-dichloro-phenyl)-4-[2'-(1H-tetrazol...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C30H28Cl2N6O2/c1-3-5-10-26-24(28(30(39)40-4-2)38(35-26)27-16-15-21(31)18-25(27)32)17-19-11-13-20(14-12-19)22-8-6-7-9-23(22)29-33-36-37-34-29/h6-9,11-16,18H,3-5,10,17H2,1-2H3,(H,33,34,36,37)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042566
PNG
(5-Butyl-2-(2,6-dichloro-phenyl)-4-[2'-(1H-tetrazol...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1c(Cl)cccc1Cl |(-5.09,-5.33,;-3.94,-6.35,;-2.49,-5.88,;-1.35,-6.91,;.12,-6.44,;.59,-4.97,;2.13,-4.97,;2.62,-6.42,;4.08,-6.91,;4.37,-7.75,;5.23,-5.88,;6.7,-6.35,;7.84,-5.33,;1.36,-7.33,;1.36,-8.87,;2.69,-9.64,;4.04,-8.87,;5.37,-9.64,;5.37,-11.18,;4.04,-11.95,;2.71,-11.18,;6.7,-11.95,;6.7,-13.49,;8.03,-14.26,;9.36,-13.49,;9.36,-11.95,;8.03,-11.18,;8.01,-9.64,;9.25,-8.73,;8.78,-7.28,;7.24,-7.29,;6.77,-8.75,;3.04,-3.72,;2.41,-2.32,;.89,-2.17,;3.31,-1.08,;4.85,-1.24,;5.48,-2.64,;4.58,-3.88,;5.91,-4.65,)|
Show InChI InChI=1S/C30H28Cl2N6O2/c1-3-5-13-26-23(27(30(39)40-4-2)38(35-26)28-24(31)11-8-12-25(28)32)18-19-14-16-20(17-15-19)21-9-6-7-10-22(21)29-33-36-37-34-29/h6-12,14-17H,3-5,13,18H2,1-2H3,(H,33,34,36,37)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042557
PNG
(5-Butyl-2-(2-nitro-phenyl)-4-[2'-(1H-tetrazol-5-yl...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C30H29N7O4/c1-3-5-12-25-24(28(30(38)41-4-2)36(33-25)26-13-8-9-14-27(26)37(39)40)19-20-15-17-21(18-16-20)22-10-6-7-11-23(22)29-31-34-35-32-29/h6-11,13-18H,3-5,12,19H2,1-2H3,(H,31,32,34,35)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042561
PNG
(5-Butyl-2-(2-chloro-phenyl)-4-[2'-(1H-tetrazol-5-y...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1Cl
Show InChI InChI=1S/C30H29ClN6O2/c1-3-5-13-26-24(28(30(38)39-4-2)37(34-26)27-14-9-8-12-25(27)31)19-20-15-17-21(18-16-20)22-10-6-7-11-23(22)29-32-35-36-33-29/h6-12,14-18H,3-5,13,19H2,1-2H3,(H,32,33,35,36)
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n/an/a 13n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042532
PNG
(5-Butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1C
Show InChI InChI=1S/C31H32N6O2/c1-4-6-14-27-26(29(31(38)39-5-2)37(34-27)28-15-10-7-11-21(28)3)20-22-16-18-23(19-17-22)24-12-8-9-13-25(24)30-32-35-36-33-30/h7-13,15-19H,4-6,14,20H2,1-3H3,(H,32,33,35,36)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042529
PNG
(5-Butyl-2-pyridin-2-yl-4-[2'-(1H-tetrazol-5-yl)-bi...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccn1
Show InChI InChI=1S/C29H29N7O2/c1-3-5-12-25-24(27(29(37)38-4-2)36(33-25)26-13-8-9-18-30-26)19-20-14-16-21(17-15-20)22-10-6-7-11-23(22)28-31-34-35-32-28/h6-11,13-18H,3-5,12,19H2,1-2H3,(H,31,32,34,35)
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n/an/a 18n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042546
PNG
(2-(2,6-Dichloro-phenyl)-5-propyl-4-[2'-(1H-tetrazo...)
Show SMILES CCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1c(Cl)cccc1Cl |(-3.03,-3.44,;-1.58,-2.96,;-.44,-4,;1.03,-3.52,;1.5,-2.05,;3.04,-2.05,;3.53,-3.51,;4.99,-3.99,;5.28,-4.84,;6.14,-2.96,;7.61,-3.44,;8.75,-2.41,;2.27,-4.42,;2.27,-5.96,;3.6,-6.73,;4.95,-5.96,;6.28,-6.73,;6.28,-8.27,;4.95,-9.04,;3.62,-8.27,;7.61,-9.04,;7.61,-10.58,;8.94,-11.35,;10.27,-10.58,;10.27,-9.04,;8.94,-8.27,;8.92,-6.73,;10.16,-5.82,;9.69,-4.36,;8.15,-4.37,;7.68,-5.83,;3.95,-.8,;3.32,.6,;1.8,.75,;4.21,1.84,;5.76,1.68,;6.39,.27,;5.49,-.96,;6.82,-1.73,)|
Show InChI InChI=1S/C29H26Cl2N6O2/c1-3-8-25-22(26(29(38)39-4-2)37(34-25)27-23(30)11-7-12-24(27)31)17-18-13-15-19(16-14-18)20-9-5-6-10-21(20)28-32-35-36-33-28/h5-7,9-16H,3-4,8,17H2,1-2H3,(H,32,33,35,36)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042567
PNG
(5-Butyl-2-(4-methoxy-phenyl)-4-[2'-(1H-tetrazol-5-...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(OC)cc1
Show InChI InChI=1S/C31H32N6O3/c1-4-6-11-28-27(29(31(38)40-5-2)37(34-28)23-16-18-24(39-3)19-17-23)20-21-12-14-22(15-13-21)25-9-7-8-10-26(25)30-32-35-36-33-30/h7-10,12-19H,4-6,11,20H2,1-3H3,(H,32,33,35,36)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042540
PNG
(5-Butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C31H29F3N6O2/c1-3-5-13-26-24(28(30(41)42-4-2)40(37-26)27-14-9-8-12-25(27)31(32,33)34)19-20-15-17-21(18-16-20)22-10-6-7-11-23(22)29-35-38-39-36-29/h6-12,14-18H,3-5,13,19H2,1-2H3,(H,35,36,38,39)
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n/an/a 21n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042552
PNG
(2-Benzyl-5-propyl-4-[2'-(1H-tetrazol-5-yl)-bipheny...)
Show SMILES CCCc1nn(Cc2ccccc2)c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C30H30N6O2/c1-3-10-27-26(28(30(37)38-4-2)36(33-27)20-22-11-6-5-7-12-22)19-21-15-17-23(18-16-21)24-13-8-9-14-25(24)29-31-34-35-32-29/h5-9,11-18H,3-4,10,19-20H2,1-2H3,(H,31,32,34,35)
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n/an/a 22n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042562
PNG
(2-Biphenyl-2-yl-5-butyl-4-[2'-(1H-tetrazol-5-yl)-b...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1-c1ccccc1
Show InChI InChI=1S/C36H34N6O2/c1-3-5-18-32-31(24-25-20-22-27(23-21-25)28-15-9-10-17-30(28)35-37-40-41-38-35)34(36(43)44-4-2)42(39-32)33-19-12-11-16-29(33)26-13-7-6-8-14-26/h6-17,19-23H,3-5,18,24H2,1-2H3,(H,37,38,40,41)
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n/an/a 23n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042541
PNG
(5-Butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)
Show SMILES CCCCc1nn(CC(F)(F)F)c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C26H27F3N6O2/c1-3-5-10-22-21(23(25(36)37-4-2)35(32-22)16-26(27,28)29)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)24-30-33-34-31-24/h6-9,11-14H,3-5,10,15-16H2,1-2H3,(H,30,31,33,34)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042528
PNG
(5-Butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1c(Cl)cc(Cl)cc1Cl |(-5.8,-11.85,;-4.26,-11.87,;-3.45,-10.55,;-1.91,-10.57,;-1.02,-9.31,;-1.5,-7.84,;-.25,-6.94,;1.01,-7.84,;2.47,-7.38,;3.96,-8.12,;2.8,-5.87,;4.28,-5.45,;4.68,-3.96,;.52,-9.31,;1.42,-10.57,;2.96,-10.55,;3.73,-11.88,;5.27,-11.88,;6.03,-10.55,;5.24,-9.22,;3.72,-9.24,;7.57,-10.53,;8.34,-11.88,;9.88,-11.87,;10.63,-10.53,;9.86,-9.19,;8.32,-9.21,;7.77,-7.74,;9.03,-6.84,;8.57,-5.37,;7.04,-5.37,;6.54,-6.83,;-.64,-5.43,;.46,-4.34,;1.87,-4.11,;.04,-2.86,;-1.43,-2.45,;-1.85,-.94,;-2.52,-3.56,;-2.12,-5.04,;-3.26,-6.11,)|
Show InChI InChI=1S/C30H27Cl3N6O2/c1-3-5-10-26-23(27(30(40)41-4-2)39(36-26)28-24(32)16-20(31)17-25(28)33)15-18-11-13-19(14-12-18)21-8-6-7-9-22(21)29-34-37-38-35-29/h6-9,11-14,16-17H,3-5,10,15H2,1-2H3,(H,34,35,37,38)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50009714
PNG
(CHEMBL191 | {2-Butyl-5-chloro-3-[2'-(2H-tetrazol-5...)
Show SMILES CCCCC1=NC(Cl)C(CO)N1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1 |t:4|
Show InChI InChI=1S/C22H25ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,19,21,30H,2-3,8,13-14H2,1H3,(H,25,26,27,28)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042563
PNG
(2-Butyl-5-phenyl-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc(c(C(=O)OCC)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1
Show InChI InChI=1S/C30H30N6O2/c1-3-5-15-26-31-27(23-11-7-6-8-12-23)28(30(37)38-4-2)36(26)20-21-16-18-22(19-17-21)24-13-9-10-14-25(24)29-32-34-35-33-29/h6-14,16-19H,3-5,15,20H2,1-2H3,(H,32,33,34,35)
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n/an/a 41n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042548
PNG
(5-Butyl-2-(3-chloro-phenyl)-4-[2'-(1H-tetrazol-5-y...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cccc(Cl)c1
Show InChI InChI=1S/C30H29ClN6O2/c1-3-5-13-27-26(28(30(38)39-4-2)37(34-27)23-10-8-9-22(31)19-23)18-20-14-16-21(17-15-20)24-11-6-7-12-25(24)29-32-35-36-33-29/h6-12,14-17,19H,3-5,13,18H2,1-2H3,(H,32,33,35,36)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042553
PNG
(5-Propyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1C(F)(F)F
Show InChI InChI=1S/C30H27F3N6O2/c1-3-9-25-23(27(29(40)41-4-2)39(36-25)26-13-8-7-12-24(26)30(31,32)33)18-19-14-16-20(17-15-19)21-10-5-6-11-22(21)28-34-37-38-35-28/h5-8,10-17H,3-4,9,18H2,1-2H3,(H,34,35,37,38)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042530
PNG
(5-Cyclopropylmethyl-2-(2,6-dichloro-phenyl)-4-[2'-...)
Show SMILES CCOC(=O)c1c(Cc2ccc(cc2)-c2ccccc2-c2nnn[nH]2)c(CC2CC2)nn1-c1c(Cl)cccc1Cl |(8.75,-2.41,;7.61,-3.44,;6.14,-2.96,;4.99,-3.99,;5.28,-4.84,;3.53,-3.51,;2.27,-4.42,;2.27,-5.96,;3.6,-6.73,;4.95,-5.96,;6.28,-6.73,;6.28,-8.27,;4.95,-9.04,;3.62,-8.27,;7.61,-9.04,;7.61,-10.58,;8.94,-11.35,;10.27,-10.58,;10.27,-9.04,;8.94,-8.27,;8.92,-6.73,;10.16,-5.82,;9.69,-4.36,;8.15,-4.37,;7.68,-5.83,;1.03,-3.52,;-.44,-4,;-1.58,-2.96,;-2.03,-1.5,;-3.07,-2.66,;1.5,-2.05,;3.04,-2.05,;3.95,-.8,;3.32,.6,;1.8,.75,;4.21,1.84,;5.76,1.68,;6.39,.27,;5.49,-.96,;6.82,-1.73,)|
Show InChI InChI=1S/C30H26Cl2N6O2/c1-2-40-30(39)27-23(26(17-19-10-11-19)35-38(27)28-24(31)8-5-9-25(28)32)16-18-12-14-20(15-13-18)21-6-3-4-7-22(21)29-33-36-37-34-29/h3-9,12-15,19H,2,10-11,16-17H2,1H3,(H,33,34,36,37)
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n/an/a 76n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042549
PNG
(5-Propyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCCc1nn(CC(F)(F)F)c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C25H25F3N6O2/c1-3-7-21-20(22(24(35)36-4-2)34(31-21)15-25(26,27)28)14-16-10-12-17(13-11-16)18-8-5-6-9-19(18)23-29-32-33-30-23/h5-6,8-13H,3-4,7,14-15H2,1-2H3,(H,29,30,32,33)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042579
PNG
(5-Butyl-2-phenyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccccc1
Show InChI InChI=1S/C30H30N6O2/c1-3-5-15-27-26(28(30(37)38-4-2)36(33-27)23-11-7-6-8-12-23)20-21-16-18-22(19-17-21)24-13-9-10-14-25(24)29-31-34-35-32-29/h6-14,16-19H,3-5,15,20H2,1-2H3,(H,31,32,34,35)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042531
PNG
(5-Butyl-2-(2,3-dichloro-phenyl)-4-[2'-(1H-tetrazol...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cccc(Cl)c1Cl
Show InChI InChI=1S/C30H28Cl2N6O2/c1-3-5-12-25-23(28(30(39)40-4-2)38(35-25)26-13-8-11-24(31)27(26)32)18-19-14-16-20(17-15-19)21-9-6-7-10-22(21)29-33-36-37-34-29/h6-11,13-17H,3-5,12,18H2,1-2H3,(H,33,34,36,37)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042560
PNG
(2-Benzyl-5-butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nn(Cc2ccccc2)c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C31H32N6O2/c1-3-5-15-28-27(29(31(38)39-4-2)37(34-28)21-23-11-7-6-8-12-23)20-22-16-18-24(19-17-22)25-13-9-10-14-26(25)30-32-35-36-33-30/h6-14,16-19H,3-5,15,20-21H2,1-2H3,(H,32,33,35,36)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042564
PNG
(5-Butyl-2-(4-chloro-phenyl)-4-[2'-(1H-tetrazol-5-y...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C30H29ClN6O2/c1-3-5-10-27-26(28(30(38)39-4-2)37(34-27)23-17-15-22(31)16-18-23)19-20-11-13-21(14-12-20)24-8-6-7-9-25(24)29-32-35-36-33-29/h6-9,11-18H,3-5,10,19H2,1-2H3,(H,32,33,35,36)
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Merck Research Laboratories

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Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042574
PNG
(5-Butyl-2-(2,5-dichloro-phenyl)-4-[2'-(1H-tetrazol...)
Show SMILES CCCCc1nn(c(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C30H28Cl2N6O2/c1-3-5-10-26-24(28(30(39)40-4-2)38(35-26)27-18-21(31)15-16-25(27)32)17-19-11-13-20(14-12-19)22-8-6-7-9-23(22)29-33-36-37-34-29/h6-9,11-16,18H,3-5,10,17H2,1-2H3,(H,33,34,36,37)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042545
PNG
(5-Butyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmeth...)
Show SMILES CCCCc1[nH]nc(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C24H26N6O2/c1-3-5-10-21-20(22(26-25-21)24(31)32-4-2)15-16-11-13-17(14-12-16)18-8-6-7-9-19(18)23-27-29-30-28-23/h6-9,11-14H,3-5,10,15H2,1-2H3,(H,25,26)(H,27,28,29,30)
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Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)		BDBM50042533
PNG
(5-Propyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCCc1[nH]nc(C(=O)OCC)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C23H24N6O2/c1-3-7-20-19(21(25-24-20)23(30)31-4-2)14-15-10-12-16(13-11-15)17-8-5-6-9-18(17)22-26-28-29-27-22/h5-6,8-13H,3-4,7,14H2,1-2H3,(H,24,25)(H,26,27,28,29)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Evaluation of Angiotensin II antagonistic activity by displacement of [125I]-Sar Ile-AII at the rabbit aorta Angiotensin II receptor, type 1

J Med Chem 36: 3595-605 (1994)


BindingDB Entry DOI: 10.7270/Q25Q4V5H
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%