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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 = 'BDBM50503906'   
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


(Homo sapiens (Human))
BDBM50503906
PNG
(CHEMBL4463575)
Show SMILES CCCCc1nc(Cl)c(CNC(=O)C(CS)CC(CC)CC)n1Cc1ccc(cc1)-c1ccccc1C(O)=O
Show InChI InChI=1S/C31H40ClN3O3S/c1-4-7-12-28-34-29(32)27(18-33-30(36)24(20-39)17-21(5-2)6-3)35(28)19-22-13-15-23(16-14-22)25-10-8-9-11-26(25)31(37)38/h8-11,13-16,21,24,39H,4-7,12,17-20H2,1-3H3,(H,33,36)(H,37,38)
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Article
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50n/an/an/an/an/an/an/an/a



Theravance Biopharma US Inc.

Curated by ChEMBL


Assay Description
Displacement of Europium-labeled angiotensin-2 from human AT1 receptor expressed in CHOK1 cell membranes after 120 mins by DELFIA


ACS Med Chem Lett 10: 86-91 (2019)


Article DOI: 10.1021/acsmedchemlett.8b00462
BindingDB Entry DOI: 10.7270/Q2D50R6V
More data for this
Ligand-Target Pair