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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Type-1 angiotensin II receptor' and Ligand = 'BDBM50035437'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Type-1 angiotensin II receptor


(RABBIT)		BDBM50035437
PNG
(CHEMBL341986 | Pentanoic acid (3-{3-butyl-4-[2'-(2...)
Show SMILES CCCCC(=O)Nc1cccc(c1C)-n1nc(CCCC)n(Cc2ccc(cc2)-c2ccccc2S(=O)(=O)NC(=O)c2ccccc2Cl)c1=O
Show InChI InChI=1S/C38H40ClN5O5S/c1-4-6-19-35-41-44(33-17-12-16-32(26(33)3)40-36(45)20-7-5-2)38(47)43(35)25-27-21-23-28(24-22-27)29-13-9-11-18-34(29)50(48,49)42-37(46)30-14-8-10-15-31(30)39/h8-18,21-24H,4-7,19-20,25H2,1-3H3,(H,40,45)(H,42,46)
PDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 24n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Tested for in vitro binding affinity against angiotensin I (AT1) receptor to competitively block the specific binding of [125I]- [Sar1,Ile8] AII to a...

J Med Chem 37: 4464-78 (1995)


BindingDB Entry DOI: 10.7270/Q2WD3ZK5
More data for this
Ligand-Target Pair