Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM50567160
Substrate
n/a
Meas. Tech.
ChEMBL_2102447 (CHEMBL4810843)
EC50
0.050000±n/a nM
Citation
 Tora, G; Jiang, J; Bostwick, JS; Gargalovic, PS; Onorato, JM; Luk, CE; Generaux, C; Xu, C; Galella, MA; Wang, T; He, Y; Wexler, RR; Finlay, HJ Identification of 6-hydroxy-5-phenyl sulfonylpyrimidin-4(1H)-one APJ receptor agonists. Bioorg Med Chem Lett 50:0 (2021) [PubMed]  Article 
Target
Name:
Apelin receptor
Synonyms:
APJ_MOUSE | Agtrl1 | Angiotensin receptor-like 1 | Apj | Aplnr | G-protein coupled receptor APJ | MSR
Type:
PROTEIN
Mol. Mass.:
42269.53
Organism:
Mus musculus
Description:
ChEMBL_120488
Residue:
377
Sequence:
MEDDGYNYYGADNQSECDYADWKPSGALIPAIYMLVFLLGTTGNGLVLWTVFRTSREKRRSADIFIASLAVADLTFVVTLPLWATYTYREFDWPFGTFSCKLSSYLIFVNMYASVFCLTGLSFDRYLAIVRPVANARLRLRVSGAVATAVLWVLAALLAVPVMVFRSTDASENGTKIQCYMDYSMVATSNSEWAWEVGLGVSSTAVGFVVPFTIMLTCYFFIAQTIAGHFRKERIEGLRKRRRLLSIIVVLVVTFALCWMPYHLVKTLYMLGSLLHWPCDFDIFLMNVFPYCTCISYVNSCLNPFLYAFFDPRFRQACTSMLCCDQSGCKGTPHSSSAEKSASYSSGHSQGPGPNMGKGGEQMHEKSIPYSQETLVD
  
Inhibitor
Name:
BDBM50567160
Synonyms:
CHEMBL4873216
Type:
Small organic molecule
Emp. Form.:
C27H27N3O6S
Mol. Mass.:
521.585
SMILES:
CCCCc1nc(=O)c(c(O)n1-c1c(OC)cccc1OC)S(=O)(=O)c1ccc(cc1)-c1cccnc1 |(55.23,-6.18,;56.56,-6.95,;57.89,-6.19,;59.23,-6.95,;60.56,-6.19,;60.56,-4.64,;61.89,-3.87,;61.89,-2.33,;63.23,-4.64,;63.23,-6.19,;64.57,-6.95,;61.89,-6.96,;61.9,-8.49,;63.23,-9.26,;64.56,-8.49,;65.89,-9.25,;63.23,-10.8,;61.89,-11.57,;60.56,-10.8,;60.56,-9.26,;59.23,-8.49,;57.89,-9.26,;64.55,-3.86,;63.78,-2.52,;65.32,-2.52,;65.89,-4.63,;65.89,-6.16,;67.23,-6.93,;68.56,-6.15,;68.55,-4.6,;67.21,-3.85,;69.9,-6.91,;71.22,-6.14,;72.56,-6.89,;72.57,-8.44,;71.24,-9.22,;69.9,-8.46,)|
Structure:
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