Target
Apelin receptor
Ligand
BDBM499618
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
29.0±n/a nM
Citation
 Chen, YDransfield, PJHarvey, JSHeath, JAHouze, JKhakoo, AYKopecky, DJLai, SMa, ZNishimura, NPattaropong, VSwaminath, GYeh, WRamsden, PD Cycloalkyl substituted triazole compounds as agonists of the APJ receptor US Patent  US11020395 Publication Date 6/1/2021 
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:
BDBM499618
Synonyms:
US11020395, Example 218.0 | US11020395, Example 219.0
Type:
Small organic molecule
Emp. Form.:
C23H27ClN6O4S
Mol. Mass.:
519.016
SMILES:
COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(Cl)cn2)nnc1[C@H]1CC11CC1 |r,wU:16.17,18.19,wD:30.32,(-7.4,7.79,;-6.06,7.02,;-4.73,7.79,;-4.73,9.33,;-3.4,10.1,;-2.06,9.33,;-2.06,7.79,;-.73,7.02,;.6,7.79,;-3.4,7.02,;-3.4,5.48,;-2.15,4.58,;-.66,4.98,;.43,3.89,;-1.06,3.49,;1.51,2.8,;1.91,4.29,;2.31,5.77,;3,3.2,;2.6,1.71,;4.49,3.6,;5.58,2.51,;7.07,2.91,;7.46,4.39,;8.95,4.79,;6.38,5.48,;4.89,5.08,;-2.63,3.11,;-4.17,3.11,;-4.64,4.58,;-5.98,5.35,;-7.07,6.44,;-7.46,4.95,;-8.95,4.55,;-7.86,3.46,)|
Structure:
Search PDB for entries with ligand similarity: