Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499487
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
1.10±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:
BDBM499487
Synonyms:
US11020395, Example 17.0
Type:
Small organic molecule
Emp. Form.:
C24H32N6O4S
Mol. Mass.:
500.614
SMILES:
COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1CCCC1 |r,wU:16.17,18.19,(.58,1.37,;-.75,.6,;-2.09,1.37,;-2.09,2.91,;-3.42,3.68,;-4.76,2.91,;-4.76,1.37,;-6.09,.6,;-7.42,1.37,;-3.42,.6,;-3.42,-.94,;-2.18,-1.85,;-.71,-1.37,;.62,-2.14,;-.71,-2.91,;1.96,-2.91,;1.96,-1.37,;1.96,.17,;3.29,-2.14,;3.29,-3.68,;4.62,-1.37,;5.96,-2.14,;7.29,-1.37,;7.29,.17,;8.62,.94,;5.96,.94,;4.62,.17,;-2.65,-3.31,;-4.19,-3.31,;-4.67,-1.85,;-6.13,-1.37,;-6.61,.1,;-8.15,.1,;-8.62,-1.37,;-7.38,-2.27,)|