Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499482
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
21.0±n/a nM
Citation
Chen, Y; Dransfield, PJ; Harvey, JS; Heath, JA; Houze, J; Khakoo, AY; Kopecky, DJ; Lai, S; Ma, Z; Nishimura, N; Pattaropong, V; Swaminath, G; Yeh, W; Ramsden, PD Cycloalkyl substituted triazole compounds as agonists of the APJ receptor US Patent US11020395 Publication Date 6/1/2021
More Info.:
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:
BDBM499482
Synonyms:
US11020395, Example 4.0
Type:
Small organic molecule
Emp. Form.:
C21H28N8O4S
Mol. Mass.:
488.563
SMILES:
COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1CCC1 |r,wU:16.17,18.19,(.45,1.41,;-.89,.64,;-2.22,1.41,;-2.22,2.95,;-3.55,3.72,;-4.89,2.95,;-4.89,1.41,;-6.22,.64,;-7.55,1.41,;-3.55,.64,;-3.55,-.9,;-2.31,-1.81,;-.82,-1.41,;.51,-2.18,;-.82,-2.95,;1.85,-2.95,;1.85,-1.41,;1.85,.13,;3.18,-2.18,;3.18,-3.72,;4.52,-1.41,;5.85,-2.18,;7.18,-1.41,;7.18,.13,;8.52,.9,;5.85,.9,;4.52,.13,;-2.78,-3.27,;-4.32,-3.27,;-4.8,-1.81,;-6.34,-1.81,;-7.43,-.72,;-8.52,-1.81,;-7.43,-2.9,)|