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13 similar compounds to monomer 50240609

Compile data set for download or QSAR
Wt: 492.4
BDBM50031966
Wt: 440.4
BDBM50044373
Wt: 494.4
BDBM50044381
Wt: 482.5
BDBM50044383
Wt: 440.4
BDBM50044385
Wt: 440.4
BDBM50044390
Wt: 482.5
BDBM50044394
Wt: 454.4
BDBM50044396
Purchase
Wt: 466.4
BDBM50044397
Wt: 508.4
BDBM50044398
Wt: 440.4
BDBM50044401
Wt: 426.4
BDBM50044403
Wt: 454.4
BDBM50044405

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 13 hits for monomerid = 50031966,50044373,50044381,50044383,50044385,50044390,50044394,50044396,50044397,50044398,50044401,50044403,50044405   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Angiotensin II receptor


(Homo sapiens (Human))
BDBM50031966
PNG
(2-Ethoxy-3-[5-oxo-11-(1H-tetrazol-5-yl)-5H-dibenzo...)
Show SMILES CCOc1nc2cccc(C(O)=O)c2n1Cc1ccc2c(cc3ccccc3c(=O)c2c1)-c1nnn[nH]1
Show InChI InChI=1S/C27H20N6O4/c1-2-37-27-28-22-9-5-8-19(26(35)36)23(22)33(27)14-15-10-11-18-20(12-15)24(34)17-7-4-3-6-16(17)13-21(18)25-29-31-32-30-25/h3-13H,2,14H2,1H3,(H,35,36)(H,29,30,31,32)
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2.70n/an/an/an/an/an/an/an/a



Shionogi & Co., Ltd.

Curated by ChEMBL


Assay Description
Ability to displace [125I]-AII binding to COS cells transfected with a cDNA encoding human Angiotensin II receptor, type 1


J Med Chem 38: 2728-41 (1995)


Article DOI: 10.1021/jm00014a024
BindingDB Entry DOI: 10.7270/Q23B5Z5Q
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044381
PNG
(3-[2'-(1H-Tetrazol-5-yl)-biphenyl-4-ylmethyl]-2-(2...)
Show SMILES OC(=O)c1cccc2nc(OCC(F)(F)F)n(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)c12
Show InChI InChI=1S/C24H17F3N6O3/c25-24(26,27)13-36-23-28-19-7-3-6-18(22(34)35)20(19)33(23)12-14-8-10-15(11-9-14)16-4-1-2-5-17(16)21-29-31-32-30-21/h1-11H,12-13H2,(H,34,35)(H,29,30,31,32)
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n/an/a 580n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044383
PNG
(2-Butoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCCCOc1nc2cccc(C(=O)OC)c2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C27H26N6O3/c1-3-4-16-36-27-28-23-11-7-10-22(26(34)35-2)24(23)33(27)17-18-12-14-19(15-13-18)20-8-5-6-9-21(20)25-29-31-32-30-25/h5-15H,3-4,16-17H2,1-2H3,(H,29,30,31,32)
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n/an/a>1.00E+3n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044385
PNG
(2-Ethoxy-1-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCOc1nc2cc(ccc2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(O)=O
Show InChI InChI=1S/C24H20N6O3/c1-2-33-24-25-20-13-17(23(31)32)11-12-21(20)30(24)14-15-7-9-16(10-8-15)18-5-3-4-6-19(18)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)
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n/an/a 1.30E+4n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044390
PNG
(2-Methoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylme...)
Show SMILES COC(=O)c1cccc2nc(OC)n(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)c12
Show InChI InChI=1S/C24H20N6O3/c1-32-23(31)19-8-5-9-20-21(19)30(24(25-20)33-2)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,14H2,1-2H3,(H,26,27,28,29)
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n/an/a 490n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044401
PNG
(2-Ethoxy-1-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCOc1nc2c(cccc2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(O)=O
Show InChI InChI=1S/C24H20N6O3/c1-2-33-24-25-21-19(23(31)32)8-5-9-20(21)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)
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n/an/a 4.50E+4n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044398
PNG
(3-[2'-(1H-Tetrazol-5-yl)-biphenyl-4-ylmethyl]-2-(2...)
Show SMILES COC(=O)c1cccc2nc(OCC(F)(F)F)n(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)c12
Show InChI InChI=1S/C25H19F3N6O3/c1-36-23(35)19-7-4-8-20-21(19)34(24(29-20)37-14-25(26,27)28)13-15-9-11-16(12-10-15)17-5-2-3-6-18(17)22-30-32-33-31-22/h2-12H,13-14H2,1H3,(H,30,31,32,33)
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n/an/a>1.00E+3n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044397
PNG
(2-Allyloxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylm...)
Show SMILES COC(=O)c1cccc2nc(OCC=C)n(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)c12
Show InChI InChI=1S/C26H22N6O3/c1-3-15-35-26-27-22-10-6-9-21(25(33)34-2)23(22)32(26)16-17-11-13-18(14-12-17)19-7-4-5-8-20(19)24-28-30-31-29-24/h3-14H,1,15-16H2,2H3,(H,28,29,30,31)
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n/an/a 850n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044394
PNG
(2-Propoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylme...)
Show SMILES CCCOc1nc2cccc(C(=O)OCC)c2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C27H26N6O3/c1-3-16-36-27-28-23-11-7-10-22(26(34)35-4-2)24(23)33(27)17-18-12-14-19(15-13-18)20-8-5-6-9-21(20)25-29-31-32-30-25/h5-15H,3-4,16-17H2,1-2H3,(H,29,30,31,32)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044405
PNG
(2-Propoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylme...)
Show SMILES CCCOc1nc2cccc(C(O)=O)c2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C25H22N6O3/c1-2-14-34-25-26-21-9-5-8-20(24(32)33)22(21)31(25)15-16-10-12-17(13-11-16)18-6-3-4-7-19(18)23-27-29-30-28-23/h3-13H,2,14-15H2,1H3,(H,32,33)(H,27,28,29,30)
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n/an/a 190n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044403
PNG
(2-Methoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylme...)
Show SMILES COc1nc2cccc(C(O)=O)c2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C23H18N6O3/c1-32-23-24-19-8-4-7-18(22(30)31)20(19)29(23)13-14-9-11-15(12-10-14)16-5-2-3-6-17(16)21-25-27-28-26-21/h2-12H,13H2,1H3,(H,30,31)(H,25,26,27,28)
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n/an/a 32n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044373
PNG
(2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCOc1nc2ccc(cc2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(O)=O
Show InChI InChI=1S/C24H20N6O3/c1-2-33-24-25-20-12-11-17(23(31)32)13-21(20)30(24)14-15-7-9-16(10-8-15)18-5-3-4-6-19(18)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)
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n/an/a 930n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50044396
PNG
(2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCOc1nc2cccc(C(=O)OC)c2n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C25H22N6O3/c1-3-34-25-26-21-10-6-9-20(24(32)33-2)22(21)31(25)15-16-11-13-17(14-12-16)18-7-4-5-8-19(18)23-27-29-30-28-23/h4-14H,3,15H2,1-2H3,(H,27,28,29,30)
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n/an/a 66n/an/an/an/an/an/a



Takeda Chemical Industries, Ltd.

Curated by ChEMBL


Assay Description
Inhibition of specific binding of [125 I ] Angiotensin-II (0.2 nM) to bovine adrenal cortex


J Med Chem 36: 2182-95 (1993)


Article DOI: 10.1021/jm00067a016
BindingDB Entry DOI: 10.7270/Q20Z73X8
More data for this
Ligand-Target Pair