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PubMed code 17064065

Compile data set for download or QSAR
Found 6 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)
BDBM50145972
PNG
(2-Amino-4-[4-(5,7-dimethyl-2-propyl-imidazo[4,5-b]...)
Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(N)nc2ccccc12
Show InChI InChI=1S/C28H27N5O2/c1-4-7-22-32-25-16(2)14-17(3)30-27(25)33(22)15-18-10-12-19(13-11-18)23-20-8-5-6-9-21(20)31-26(29)24(23)28(34)35/h5-6,8-14H,4,7,15H2,1-3H3,(H2,29,31)(H,34,35)
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Article
PubMed
n/an/a 3.30n/an/an/an/an/an/a



Università di Siena

Curated by ChEMBL


Assay Description
Antagonist activity against AT1 receptor assessed as inhibition of Ang2-induced rabit aortic strip contraction


J Med Chem 49: 6451-64 (2006)


Article DOI: 10.1021/jm0603163
BindingDB Entry DOI: 10.7270/Q2WW7H9J
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)
BDBM50197079
PNG
(1,2-dihydro-4-[4-[(5,7-dimethyl-2-ethyl-3H-imidazo...)
Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)n(C)c(=O)c2ccccc12
Show InChI InChI=1S/C28H26N4O3/c1-5-22-30-24-16(2)14-17(3)29-26(24)32(22)15-18-10-12-19(13-11-18)23-20-8-6-7-9-21(20)27(33)31(4)25(23)28(34)35/h6-14H,5,15H2,1-4H3,(H,34,35)
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Article
PubMed
n/an/a 4.60n/an/an/an/an/an/a



Università di Siena

Curated by ChEMBL


Assay Description
Antagonist activity against AT1 receptor assessed as inhibition of Ang2-induced rabit aortic strip contraction


J Med Chem 49: 6451-64 (2006)


Article DOI: 10.1021/jm0603163
BindingDB Entry DOI: 10.7270/Q2WW7H9J
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)
BDBM50145979
PNG
(4-(4-((2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyrid...)
Show SMILES CCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(cnc2ccccc12)-c1nnn[nH]1
Show InChI InChI=1S/C27H24N8/c1-4-23-30-25-16(2)13-17(3)29-27(25)35(23)15-18-9-11-19(12-10-18)24-20-7-5-6-8-22(20)28-14-21(24)26-31-33-34-32-26/h5-14H,4,15H2,1-3H3,(H,31,32,33,34)
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PubMed
n/an/a 8.90n/an/an/an/an/an/a



Università di Siena

Curated by ChEMBL


Assay Description
Antagonist activity against AT1 receptor assessed as inhibition of Ang2-induced rabit aortic strip contraction


J Med Chem 49: 6451-64 (2006)


Article DOI: 10.1021/jm0603163
BindingDB Entry DOI: 10.7270/Q2WW7H9J
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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PubMed
n/an/a 10n/an/an/an/an/an/a



Università di Siena

Curated by ChEMBL


Assay Description
Antagonist activity against AT1 receptor assessed as inhibition of Ang2-induced rabit aortic strip contraction


J Med Chem 49: 6451-64 (2006)


Article DOI: 10.1021/jm0603163
BindingDB Entry DOI: 10.7270/Q2WW7H9J
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)
BDBM50145981
PNG
(4-(4-((5,7-dimethyl-2-propyl-3H-imidazo[4,5-b]pyri...)
Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)-c1c(C(O)=O)c(C)nc2ccccc12
Show InChI InChI=1S/C29H28N4O2/c1-5-8-24-32-27-17(2)15-18(3)30-28(27)33(24)16-20-11-13-21(14-12-20)26-22-9-6-7-10-23(22)31-19(4)25(26)29(34)35/h6-7,9-15H,5,8,16H2,1-4H3,(H,34,35)
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Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Università di Siena

Curated by ChEMBL


Assay Description
Antagonist activity against AT1 receptor assessed as inhibition of Ang2-induced rabit aortic strip contraction


J Med Chem 49: 6451-64 (2006)


Article DOI: 10.1021/jm0603163
BindingDB Entry DOI: 10.7270/Q2WW7H9J
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)
BDBM50197082
PNG
(3-[4-[(5,7-dimethyl-2-propyl-3H-imidazo[4,5-b]pyri...)
Show SMILES CCCc1nc2c(C)cc(C)nc2n1Cc1ccc(cc1)C1C(C(O)=O)C(C)(O)c2ccccc12
Show InChI InChI=1S/C29H31N3O3/c1-5-8-23-31-26-17(2)15-18(3)30-27(26)32(23)16-19-11-13-20(14-12-19)24-21-9-6-7-10-22(21)29(4,35)25(24)28(33)34/h6-7,9-15,24-25,35H,5,8,16H2,1-4H3,(H,33,34)
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PC cid
PC sid
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Article
PubMed
n/an/a 33n/an/an/an/an/an/a



Università di Siena

Curated by ChEMBL


Assay Description
Antagonist activity against AT1 receptor assessed as inhibition of Ang2-induced rabit aortic strip contraction


J Med Chem 49: 6451-64 (2006)


Article DOI: 10.1021/jm0603163
BindingDB Entry DOI: 10.7270/Q2WW7H9J
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%