BindingDB logo
myBDB logout

BDBM50043473 CHEMBL335289::{Ethyl-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-2-methyl-phenyl]-amino}-phenyl-acetic acid

SMILES: CCN(C(C(O)=O)c1ccccc1)c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1C

InChI Key: InChIKey=QDBQENPGIAWQQM-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 = 50043473   
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
Type-2 angiotensin II receptor


(RAT)
BDBM50043473
PNG
(CHEMBL335289 | {Ethyl-[4-(2-ethyl-5,7-dimethyl-imi...)
Show SMILES CCN(C(C(O)=O)c1ccccc1)c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1C
Show InChI InChI=1S/C28H32N4O2/c1-6-24-30-25-19(4)15-20(5)29-27(25)32(24)17-21-13-14-23(18(3)16-21)31(7-2)26(28(33)34)22-11-9-8-10-12-22/h8-16,26H,6-7,17H2,1-5H3,(H,33,34)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 8.60E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro antagonist activity against angiotensin II type 2 (AT2) receptor in rat midbrain using [125I]- Sar, Ile AII.


J Med Chem 36: 4239-49 (1994)


BindingDB Entry DOI: 10.7270/Q22V2F6P
More data for this
Ligand-Target Pair
Type-1 angiotensin II receptor


(RABBIT)
BDBM50043473
PNG
(CHEMBL335289 | {Ethyl-[4-(2-ethyl-5,7-dimethyl-imi...)
Show SMILES CCN(C(C(O)=O)c1ccccc1)c1ccc(Cn2c(CC)nc3c(C)cc(C)nc23)cc1C
Show InChI InChI=1S/C28H32N4O2/c1-6-24-30-25-19(4)15-20(5)29-27(25)32(24)17-21-13-14-23(18(3)16-21)31(7-2)26(28(33)34)22-11-9-8-10-12-22/h8-16,26H,6-7,17H2,1-5H3,(H,33,34)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 10n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro antagonist activity against angiotensin II receptor type 1 in rabbit aorta using [125I]-Sar, Ile AII.


J Med Chem 36: 4239-49 (1994)


BindingDB Entry DOI: 10.7270/Q22V2F6P
More data for this
Ligand-Target Pair