Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499642
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
71.0±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:
BDBM499642
Synonyms:
US11020395, Example 240.0
Type:
Small organic molecule
Emp. Form.:
C22H27ClN8O6S
Mol. Mass.:
567.018
SMILES:
CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC3(COC3)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:2.1,3.3,(5.6,-4.1,;4.27,-3.33,;4.27,-1.79,;2.94,-1.02,;2.94,.52,;1.6,-1.79,;.27,-2.56,;2.94,-2.56,;.27,-1.02,;-1.22,-1.42,;-1.69,-2.89,;-3.23,-2.89,;-3.71,-1.42,;-5.25,-1.42,;-6.34,-.33,;-7.43,-1.42,;-8.52,-.33,;-9.61,-1.42,;-8.52,-2.51,;-6.34,-2.51,;-2.46,-.52,;-2.46,1.02,;-3.8,1.79,;-5.13,1.02,;-6.46,1.79,;-3.8,3.33,;-2.46,4.1,;-1.13,3.33,;-1.13,1.79,;.2,1.02,;1.54,1.79,;5.6,-1.02,;6.94,-1.79,;8.27,-1.02,;8.27,.52,;9.61,1.29,;6.94,1.29,;5.6,.52,)|