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Target
Apelin receptor
Ligand
BDBM481068
Substrate
n/a
Meas. Tech.
[35S]GTPγS Binding Assay
EC50
3.50±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:
BDBM481068
Synonyms:
US10906890, Example 80.0
Type:
Small organic molecule
Emp. Form.:
C27H30N6O6S
Mol. Mass.:
566.629
SMILES:
CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccc3OCCc3c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,3.3,(5.86,-3.92,;4.52,-3.15,;4.52,-1.61,;3.19,-.84,;3.19,.7,;1.85,-1.61,;.52,-2.38,;3.19,-2.38,;.52,-.84,;-.81,-1.61,;-1.29,-3.07,;-2.83,-3.07,;-3.3,-1.61,;-4.77,-1.13,;-5.09,.37,;-6.55,.85,;-7.7,-.18,;-9.23,-.02,;-9.86,-1.43,;-8.71,-2.46,;-7.38,-1.69,;-5.91,-2.16,;-2.06,-.7,;-2.06,.84,;-3.39,1.61,;-4.73,.84,;-6.06,1.61,;-3.39,3.15,;-2.06,3.92,;-.73,3.15,;-.73,1.61,;.61,.84,;1.94,1.61,;5.86,-.84,;7.19,-1.61,;8.52,-.84,;8.52,.7,;9.86,1.47,;7.19,1.47,;5.86,.7,)|
Structure:
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