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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 B' and Ligand = 'BDBM50044342'   
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 B


(RAT)
BDBM50044342
PNG
(2-(2-Adamantan-1-yl-2-oxo-ethyl)-5-butyl-4-[2'-(1H...)
Show SMILES CCCCc1nn(CC(=O)C23C[C@H]4C[C@H](C[C@H](C4)C2)C3)c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1 |TLB:17:16:19:11.12.13,17:12:19:18.16.15|
Show InChI InChI=1S/C32H37N7O2/c1-2-3-8-29-35-39(20-28(40)32-16-22-13-23(17-32)15-24(14-22)18-32)31(41)38(29)19-21-9-11-25(12-10-21)26-6-4-5-7-27(26)30-33-36-37-34-30/h4-7,9-12,22-24H,2-3,8,13-20H2,1H3,(H,33,34,36,37)/t22-,23+,24-,32?
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PubMed
n/an/a 25n/an/an/an/an/an/a



Searle R&D

Curated by ChEMBL


Assay Description
Inhibition of [125I]-angiotensin-II binding to the angiotensin II receptor type 1 in rat uterine membranes


J Med Chem 36: 2172-81 (1993)


BindingDB Entry DOI: 10.7270/Q2C53JXM
More data for this
Ligand-Target Pair