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BDBM50042222 4'-(2,4,4-Tributyl-5-oxo-4,5-dihydro-imidazol-1-ylmethyl)-biphenyl-2-carboxylic acid::CHEMBL46782

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

InChI Key: InChIKey=LDBGBLYCWFBLDN-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50042222   
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)
BDBM50042222
PNG
(4'-(2,4,4-Tributyl-5-oxo-4,5-dihydro-imidazol-1-yl...)
Show SMILES CCCCC1=NC(CCCC)(CCCC)C(=O)N1Cc1ccc(cc1)-c1ccccc1C(O)=O
Show InChI InChI=1S/C29H38N2O3/c1-4-7-14-26-30-29(19-8-5-2,20-9-6-3)28(34)31(26)21-22-15-17-23(18-16-22)24-12-10-11-13-25(24)27(32)33/h10-13,15-18H,4-9,14,19-21H2,1-3H3,(H,32,33)
PDB

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UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 1.70E+3n/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)
BDBM50042222
PNG
(4'-(2,4,4-Tributyl-5-oxo-4,5-dihydro-imidazol-1-yl...)
Show SMILES CCCCC1=NC(CCCC)(CCCC)C(=O)N1Cc1ccc(cc1)-c1ccccc1C(O)=O
Show InChI InChI=1S/C29H38N2O3/c1-4-7-14-26-30-29(19-8-5-2,20-9-6-3)28(34)31(26)21-22-15-17-23(18-16-22)24-12-10-11-13-25(24)27(32)33/h10-13,15-18H,4-9,14,19-21H2,1-3H3,(H,32,33)
PDB

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UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.70E+3n/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)


Article DOI: 10.1021/jm00074a018
BindingDB Entry DOI: 10.7270/Q22Z14M0
More data for this
Ligand-Target Pair