Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM360486
Substrate
n/a
Meas. Tech.
[35S]GTPγS Binding
EC50
0.470±n/a nM
Citation
 Chen, N; Chen, X; Cheng, AC; Connors, RV; Deignan, J; Dransfield, PJ; Du, X; Fu, Z; Heath, JA; Horne, DB; Houze, J; Kaller, MR; Kopecky, DJ; Lai, S; Ma, Z; McGee, LR; Medina, JC; Mihalic, JT; Nishimura, N; Olson, SH; Pattaropong, V; Wang, X; Yang, K; Debenedetto, MV; Hedley, SJ Intermediates for preparing triazole agonists of the APJ receptor US Patent  US9845310 Publication Date 12/19/2017 
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:
BDBM360486
Synonyms:
(1S,2S)-N-(4-(2,6-dimethoxyphenyl)-5-(6-methyl-2-pyridinyl)-4H-1,2,4-triazol-3- | US10221162, Example 824.0 | US9845310, Example 824.0
Type:
Small organic molecule
Emp. Form.:
C27H33N7O5S
Mol. Mass.:
567.66
SMILES:
COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](OC(C)C)c2cnc(C)cn2)nnc1-c1cccc(C)n1 |r,wU:18.19,wD:16.17,(1.21,9.11,;-.12,8.34,;-1.46,9.11,;-1.46,10.65,;-2.79,11.42,;-4.12,10.65,;-4.12,9.11,;-5.46,8.34,;-6.79,9.11,;-2.79,8.34,;-2.79,6.8,;-1.55,5.9,;-.08,6.37,;1.25,5.6,;2.59,4.83,;-.08,4.83,;2.59,6.37,;2.59,7.91,;3.92,5.6,;3.92,4.06,;5.25,3.29,;5.25,1.75,;6.59,4.06,;5.25,6.37,;5.25,7.91,;6.59,8.68,;7.92,7.91,;9.26,8.68,;7.92,6.37,;6.59,5.6,;-2.02,4.43,;-3.56,4.43,;-4.04,5.9,;-5.5,6.37,;-5.82,7.88,;-7.29,8.35,;-8.43,7.32,;-8.11,5.82,;-9.26,4.79,;-6.65,5.34,)|
Structure:
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