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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 = 'BDBM50498945'   
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))
BDBM50498945
PNG
(CHEMBL3735653)
Show SMILES CSc1nc2c(C)cc(cc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC[C@H](C)c1ccccc1 |r|
Show InChI InChI=1S/C33H31N3O3S/c1-21-17-26(31(37)34-19-22(2)24-9-5-4-6-10-24)18-29-30(21)35-33(40-3)36(29)20-23-13-15-25(16-14-23)27-11-7-8-12-28(27)32(38)39/h4-18,22H,19-20H2,1-3H3,(H,34,37)(H,38,39)/t22-/m0/s1
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PC cid
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Article
PubMed
n/an/a 609n/an/an/an/an/an/a



Beijing Institute of Technology

Curated by ChEMBL


Assay Description
Displacement of [125I]Sar1Ile8-Ang2 from human AT1 receptor expressed in CHO-K1 cell membranes after 180 mins


Eur J Med Chem 103: 473-87 (2015)


Article DOI: 10.1016/j.ejmech.2015.09.010
BindingDB Entry DOI: 10.7270/Q21J9DS4
More data for this
Ligand-Target Pair