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Target
Apelin receptor
Ligand
BDBM481039
Substrate
n/a
Meas. Tech.
[35S]GTPγS Binding Assay
EC50
110±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:
BDBM481039
Synonyms:
US10906890, Example 50.0
Type:
Small organic molecule
Emp. Form.:
C24H25N9O4S
Mol. Mass.:
535.578
SMILES:
COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1-c1cccc(c1)C#N |r,wU:18.19,16.17,(-6.71,1.37,;-5.37,.6,;-4.04,1.37,;-4.04,2.91,;-2.71,3.68,;-1.37,2.91,;-1.37,1.37,;-.04,.6,;1.3,1.37,;-2.71,.6,;-2.71,-.94,;-1.46,-1.85,;.01,-1.37,;1.34,-2.14,;2.67,-2.91,;.01,-2.91,;2.67,-1.37,;2.67,.17,;4.01,-2.14,;4.01,-3.68,;5.34,-1.37,;6.67,-2.14,;8.01,-1.37,;8.01,.17,;9.34,.94,;6.67,.94,;5.34,.17,;-1.94,-3.31,;-3.48,-3.31,;-3.95,-1.85,;-5.49,-1.85,;-6.26,-3.18,;-7.8,-3.18,;-8.57,-1.85,;-7.8,-.51,;-6.26,-.51,;-8.57,.82,;-9.34,2.16,)|
Structure:
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