Reaction Details Report a problem with these data
Target
Type-1 angiotensin II receptor
Ligand
BDBM50042550
Substrate
n/a
Meas. Tech.
ChEBML_36933
IC50
0.690000±n/a nM
Citation
 Ashton, WT; Hutchins, SM; Greenlee, WJ; Doss, GA; Chang, RS; Lotti, VJ; Faust, KA; Chen, TB; Zingaro, GJ; Kivlighn, SD Nonpeptide angiotensin II antagonists derived from 1H-pyrazole-5-carboxylates and 4-aryl-1H-imidazole-5-carboxylates. J Med Chem 36:3595-605 (1994) [PubMed]  Article 
Target
Name:
Type-1 angiotensin II receptor
Synonyms:
AGTR1 | AGTR1_RABIT | ANGIOTENSIN AT1 | Angiotensin II receptor | Angiotensin II type 1a (AT-1a) receptor
Type:
Enzyme Catalytic Domain
Mol. Mass.:
41009.15
Organism:
RABBIT
Description:
ANGIOTENSIN AT1 AGTR1 RABBIT::P34976
Residue:
359
Sequence:
MMLNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLAVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNYLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLLAGLASLPAIIHRNVFFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFLFPFLIILTSYTLIWKALKKAYEIQKNKPRNDDIFKIIMAIVLFFFFSWVPHQIFTFLDVLIQLGVIHDCRIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPKAKSHSNLSTKMSTLSYRPSDNVSSSSKKPVPCFEVE
  
Inhibitor
Name:
BDBM50042550
Synonyms:
2-(2,6-Dichloro-phenyl)-5-propyl-4-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-2H-pyrazole-3-carboxylic acid | CHEMBL338740
Type:
Small organic molecule
Emp. Form.:
C27H22Cl2N6O2
Mol. Mass.:
533.409
SMILES:
CCCc1nn(c(C(O)=O)c1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)-c1c(Cl)cccc1Cl |(5.83,-9.45,;7.3,-8.97,;8.44,-10.01,;9.9,-9.53,;10.37,-8.06,;11.91,-8.06,;12.39,-9.53,;13.84,-10,;14.98,-8.97,;14.13,-11.23,;11.14,-10.44,;11.19,-12.68,;12.51,-13.44,;13.86,-12.67,;15.18,-13.44,;15.18,-14.98,;13.86,-15.74,;12.53,-14.98,;16.51,-15.74,;16.51,-17.29,;17.84,-18.05,;19.17,-17.29,;19.17,-15.74,;17.84,-14.97,;17.82,-13.44,;19.06,-12.54,;18.59,-11.07,;17.05,-11.08,;16.58,-12.54,;12.3,-6.57,;11.2,-5.5,;9.72,-5.91,;11.58,-4.01,;13.07,-3.59,;14.18,-4.68,;13.79,-6.17,;14.89,-7.25,)|
Structure:
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