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BDBM50281797 4'-(2-Butyl-7-oxo-6,7-dihydro-imidazo[4,5-d]pyridazin-1-ylmethyl)-biphenyl-2-carboxylic acid::CHEMBL7396

SMILES: CCCCc1nc2cn[nH]c(=O)c2n1Cc1ccc(cc1)-c1ccccc1C(O)=O

InChI Key: InChIKey=ZNDMLFMZBUHBMB-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50281797   
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))
BDBM50281797
PNG
(4'-(2-Butyl-7-oxo-6,7-dihydro-imidazo[4,5-d]pyrida...)
Show SMILES CCCCc1nc2cn[nH]c(=O)c2n1Cc1ccc(cc1)-c1ccccc1C(O)=O
Show InChI InChI=1S/C23H22N4O3/c1-2-3-8-20-25-19-13-24-26-22(28)21(19)27(20)14-15-9-11-16(12-10-15)17-6-4-5-7-18(17)23(29)30/h4-7,9-13H,2-3,8,14H2,1H3,(H,26,28)(H,29,30)
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PC cid
PC sid
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Similars

n/an/a 2.13E+3n/an/an/an/an/an/a


TBA

Assay Description
Displacement of monoiodinated angiotensin II from guinea-pig adrenal gland angiotensin II receptor


Citation and Details

BindingDB Entry DOI: 10.7270/Q2PG1TWM
More data for this
Ligand-Target Pair
Angiotensin II receptor


(Homo sapiens (Human))
BDBM50281797
PNG
(4'-(2-Butyl-7-oxo-6,7-dihydro-imidazo[4,5-d]pyrida...)
Show SMILES CCCCc1nc2cn[nH]c(=O)c2n1Cc1ccc(cc1)-c1ccccc1C(O)=O
Show InChI InChI=1S/C23H22N4O3/c1-2-3-8-20-25-19-13-24-26-22(28)21(19)27(20)14-15-9-11-16(12-10-15)17-6-4-5-7-18(17)23(29)30/h4-7,9-13H,2-3,8,14H2,1H3,(H,26,28)(H,29,30)
PDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 22n/an/an/an/an/an/a



The M. S. University of Baroda

Curated by ChEMBL


Assay Description
Binding affinity to angiotensin AT1 receptor


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