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BDBM50011971 3-[2-Butyl-3-(2-hydroxy-benzyl)-3H-imidazol-4-yl]-2-thiophen-2-ylmethyl-acrylic acid::CHEMBL287936

SMILES: CCCCc1ncc(\C=C(/Cc2cccs2)C(O)=O)n1Cc1ccccc1O

InChI Key: InChIKey=PWMNZOGVWNVWID-SFQUDFHCSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50011971   
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


(RAT)
BDBM50011971
PNG
(3-[2-Butyl-3-(2-hydroxy-benzyl)-3H-imidazol-4-yl]-...)
Show SMILES CCCCc1ncc(\C=C(/Cc2cccs2)C(O)=O)n1Cc1ccccc1O
Show InChI InChI=1S/C22H24N2O3S/c1-2-3-10-21-23-14-18(24(21)15-16-7-4-5-9-20(16)25)12-17(22(26)27)13-19-8-6-11-28-19/h4-9,11-12,14,25H,2-3,10,13,15H2,1H3,(H,26,27)/b17-12+
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 34n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of [125I]AII binding to Angiotensin II receptor, type 1 of rat mesenteric arteries


J Med Chem 36: 1880-92 (1993)


BindingDB Entry DOI: 10.7270/Q2PK0JC7
More data for this
Ligand-Target Pair
Angiotensin II AT2


(RAT)
BDBM50011971
PNG
(3-[2-Butyl-3-(2-hydroxy-benzyl)-3H-imidazol-4-yl]-...)
Show SMILES CCCCc1ncc(\C=C(/Cc2cccs2)C(O)=O)n1Cc1ccccc1O
Show InChI InChI=1S/C22H24N2O3S/c1-2-3-10-21-23-14-18(24(21)15-16-7-4-5-9-20(16)25)12-17(22(26)27)13-19-8-6-11-28-19/h4-9,11-12,14,25H,2-3,10,13,15H2,1H3,(H,26,27)/b17-12+
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 90n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro inhibition of [125I]-AII specific binding towards angiotensin II receptor in rat mesenteric membranes.


J Med Chem 34: 1514-7 (1991)


BindingDB Entry DOI: 10.7270/Q2TD9WBV
More data for this
Ligand-Target Pair