Reaction Details  Report a problem with these data
Target
Type-1 angiotensin II receptor
Ligand
BDBM67308
Substrate
n/a
Meas. Tech.
Dose Response screen for antagonists of Angiotensin II Receptor Type 1 to assess selectivity of uHTS small molecule antagonists hits of the APJ receptor
IC50
16913±1623 nM
Citation
 PubChem, PC Dose Response screen for antagonists of Angiotensin II Receptor Type 1 to assess selectivity of uHTS small molecule antagonists hits of the APJ receptor PubChem Bioassay (2010)[AID]
Target
Name:
Type-1 angiotensin II receptor
Synonyms:
AGTR1 | AGTR1A | AGTR1B | AGTR1_HUMAN | AT1 | AT1AR | AT1BR | AT2R1 | AT2R1B | Angiotensin II AT1 | Angiotensin II receptor | Angiotensin II type 1b (AT-1b) receptor | Type-1 angiotensin II receptor (AT1)
Type:
Protein
Mol. Mass.:
41080.75
Organism:
Homo sapiens (Human)
Description:
P30556
Residue:
359
Sequence:
MILNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNYLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLLAGLASLPAIIHRNVFFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFLFPFLIILTSYTLIWKALKKAYEIQKNKPRNDDIFKIIMAIVLFFFFSWIPHQIFTFLDVLIQLGIIRDCRIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKRYFLQLLKYIPPKAKSHSNLSTKMSTLSYRPSDNVSSSTKKPAPCFEVE
  
Inhibitor
Name:
BDBM67308
Synonyms:
4-[1-(4-methylphenyl)-2-nitro-ethyl]sulfanylaniline | 4-[1-(4-methylphenyl)-2-nitroethyl]sulfanylaniline | 4-[[1-(4-methylphenyl)-2-nitroethyl]thio]aniline | 4-{[1-(4-methylphenyl)-2-nitroethyl]thio}aniline | MLS000861888 | SMR000460672 | [4-[[2-nitro-1-(p-tolyl)ethyl]thio]phenyl]amine | cid_2733001
Type:
Small organic molecule
Emp. Form.:
C15H16N2O2S
Mol. Mass.:
288.365
SMILES:
Cc1ccc(cc1)C(C[N+]([O-])=O)Sc1ccc(N)cc1
Structure:
Search PDB for entries with ligand similarity: