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Target
Apelin receptor
Ligand
BDBM481027
Substrate
n/a
Meas. Tech.
[35S]GTPγS Binding Assay
EC50
1.90±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:
BDBM481027
Synonyms:
US10906890, Example 36.0
Type:
Small organic molecule
Emp. Form.:
C24H27N7O5S
Mol. Mass.:
525.58
SMILES:
CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2ccccc2)n1-c1c(OC)ccnc1OC)c1ncc(C)cn1 |wU:2.1,3.3,(-10.72,-6.31,;-9.25,-6.78,;-8.93,-8.29,;-7.47,-8.77,;-7.15,-10.27,;-6.32,-7.73,;-7.35,-6.59,;-5.29,-8.88,;-5.18,-6.7,;-3.71,-7.18,;-3.24,-8.64,;-1.7,-8.64,;-1.22,-7.18,;.24,-6.7,;.56,-5.2,;2.03,-4.72,;3.17,-5.75,;2.85,-7.26,;1.39,-7.73,;-2.47,-6.27,;-2.47,-4.73,;-1.13,-3.96,;.2,-4.73,;1.53,-3.96,;-1.13,-2.42,;-2.47,-1.65,;-3.8,-2.42,;-3.8,-3.96,;-5.14,-4.73,;-6.47,-3.96,;-10.08,-9.32,;-9.76,-10.83,;-10.9,-11.86,;-12.37,-11.38,;-13.51,-12.41,;-12.69,-9.87,;-11.54,-8.84,)|
Structure:
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