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BDBM50412357 CHEMBL519564

SMILES: CCCCC(=O)Nc1ccc2n(Cc3ccc(cc3)-c3ccccc3C(O)=O)c(CCCC)nc2c1

InChI Key: InChIKey=UKUBUHNENSJHLR-UHFFFAOYSA-N

Data: 1 Kd

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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 1 hit for monomerid = 50412357   
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
AGTR1


(RAT)
BDBM50412357
PNG
(CHEMBL519564)
Show SMILES CCCCC(=O)Nc1ccc2n(Cc3ccc(cc3)-c3ccccc3C(O)=O)c(CCCC)nc2c1
Show InChI InChI=1S/C30H33N3O3/c1-3-5-11-28-32-26-19-23(31-29(34)12-6-4-2)17-18-27(26)33(28)20-21-13-15-22(16-14-21)24-9-7-8-10-25(24)30(35)36/h7-10,13-19H,3-6,11-12,20H2,1-2H3,(H,31,34)(H,35,36)
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PC sid
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Similars

Article
PubMed
n/an/an/a 398n/an/an/an/an/a



Punjabi University

Curated by ChEMBL


Assay Description
Antagonist activity at AT1 receptor in rat aorta


Eur J Med Chem 43: 1808-12 (2008)


Article DOI: 10.1016/j.ejmech.2007.11.008
BindingDB Entry DOI: 10.7270/Q2BZ679K
More data for this
Ligand-Target Pair