Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM481003
Substrate
n/a
Meas. Tech.
[35S]GTPγS Binding Assay
EC50
8.50±n/a nM
Citation
 Chen, N; Chen, Y; Debenedetto, MV; Dransfield, PJ; Harvey, JS; Heath, JA; Houze, J; Khakoo, AY; Lai, S; Ma, Z; Nishimura, N; Pattaropong, V; Swaminath, G; Yeh, W; Kreiman, C Triazole phenyl compounds as agonists of the APJ receptor US Patent  US10906890 Publication Date 2/2/2021 
Target
Name:
Apelin receptor
Synonyms:
AGTRL1 | APJ | APJ_HUMAN | APLNR | Angiotensin receptor-like 1 | Apelin receptor | Apelin receptor (APJ) | G-protein coupled receptor APJ | G-protein coupled receptor HG11
Type:
Enzyme Catalytic Domain
Mol. Mass.:
42664.06
Organism:
Homo sapiens (Human)
Description:
P35414
Residue:
380
Sequence:
MEEGGDFDNYYGADNQSECEYTDWKSSGALIPAIYMLVFLLGTTGNGLVLWTVFRSSREKRRSADIFIASLAVADLTFVVTLPLWATYTYRDYDWPFGTFFCKLSSYLIFVNMYASVFCLTGLSFDRYLAIVRPVANARLRLRVSGAVATAVLWVLAALLAMPVMVLRTTGDLENTTKVQCYMDYSMVATVSSEWAWEVGLGVSSTTVGFVVPFTIMLTCYFFIAQTIAGHFRKERIEGLRKRRRLLSIIVVLVVTFALCWMPYHLVKTLYMLGSLLHWPCDFDLFLMNIFPYCTCISYVNSCLNPFLYAFFDPRFRQACTSMLCCGQSRCAGTSHSSSGEKSASYSSGHSQGPGPNMGKGGEQMHEKSIPYSQETLVVD
  
Inhibitor
Name:
BDBM481003
Synonyms:
US10906890, Example 12.0
Type:
Small organic molecule
Emp. Form.:
C25H22FN5O4S
Mol. Mass.:
507.537
SMILES:
COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(F)cc2C#N)nnc1-c1ccccc1 |(-6.57,1.25,;-5.24,.48,;-3.9,1.25,;-3.9,2.79,;-2.57,3.56,;-1.23,2.79,;-1.23,1.25,;.1,.48,;1.43,1.25,;-2.57,.48,;-2.57,-1.06,;-1.32,-1.97,;.01,-1.2,;1.34,-1.97,;.26,-3.05,;2.68,-2.74,;2.43,-.88,;3.92,-1.28,;5.01,-.19,;4.61,1.3,;5.7,2.39,;7.19,1.99,;8.28,3.08,;7.59,.5,;6.5,-.58,;6.9,-2.07,;7.29,-3.56,;-1.8,-3.43,;-3.34,-3.43,;-3.81,-1.97,;-5.3,-1.57,;-5.7,-.08,;-7.19,.32,;-8.28,-.77,;-7.88,-2.26,;-6.39,-2.66,)|
Structure:
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