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BDBM50042240 4'-(2-Butyl-4,4-diethyl-5-oxo-4,5-dihydro-imidazol-1-ylmethyl)-biphenyl-2-carboxylic acid::CHEMBL296883

SMILES: CCCCC1=NC(CC)(CC)C(=O)N1Cc1ccc(cc1)-c1ccccc1C(O)=O

InChI Key: InChIKey=LCPYFBSBBAXCRH-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 = 50042240   
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 AT1B


(RAT)
BDBM50042240
PNG
(4'-(2-Butyl-4,4-diethyl-5-oxo-4,5-dihydro-imidazol...)
Show SMILES CCCCC1=NC(CC)(CC)C(=O)N1Cc1ccc(cc1)-c1ccccc1C(O)=O |t:4|
Show InChI InChI=1S/C25H30N2O3/c1-4-7-12-22-26-25(5-2,6-3)24(30)27(22)17-18-13-15-19(16-14-18)20-10-8-9-11-21(20)23(28)29/h8-11,13-16H,4-7,12,17H2,1-3H3,(H,28,29)
PDB

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PC cid
PC sid
UniChem

Similars

Article
n/an/a 56n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro binding affinity at Angiotensin II receptor, type 1 from rat liver membrane by [125I]- A II displacement.


Bioorg Med Chem Lett 4: 163-168 (1994)


Article DOI: 10.1016/S0960-894X(01)81140-9
BindingDB Entry DOI: 10.7270/Q2M045CQ
More data for this
Ligand-Target Pair
Angiotensin II AT1B


(RAT)
BDBM50042240
PNG
(4'-(2-Butyl-4,4-diethyl-5-oxo-4,5-dihydro-imidazol...)
Show SMILES CCCCC1=NC(CC)(CC)C(=O)N1Cc1ccc(cc1)-c1ccccc1C(O)=O |t:4|
Show InChI InChI=1S/C25H30N2O3/c1-4-7-12-22-26-25(5-2,6-3)24(30)27(22)17-18-13-15-19(16-14-18)20-10-8-9-11-21(20)23(28)29/h8-11,13-16H,4-7,12,17H2,1-3H3,(H,28,29)
PDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 56n/an/an/an/an/an/a



Sanofi Recherche

Curated by ChEMBL


Assay Description
Binding affinity for Angiotensin II receptor, type 1 measured by ability to displace [125I]- A II from its specific binding site in rat liver membran...


J Med Chem 36: 3371-80 (1993)


BindingDB Entry DOI: 10.7270/Q22Z14M0
More data for this
Ligand-Target Pair