Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499520
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
0.920±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:
BDBM499520
Synonyms:
US11020395, Example 105.0 | US11020395, Example 106.0
Type:
Small organic molecule
Emp. Form.:
C21H25ClN8O5S
Mol. Mass.:
536.992
SMILES:
CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2CC22CC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,(4.68,.83,;3.35,1.6,;3.35,3.14,;2.02,3.91,;2.02,5.45,;.68,3.14,;-.09,1.81,;1.45,1.81,;-.65,3.91,;-1.99,3.14,;-2.46,1.68,;-4,1.68,;-4.48,3.14,;-6.02,3.14,;-7.35,3.91,;-7.35,2.37,;-8.68,1.6,;-7.35,.83,;-3.23,4.05,;-3.23,5.59,;-4.56,6.36,;-5.9,5.59,;-7.23,6.36,;-4.56,7.9,;-3.23,8.67,;-1.9,7.9,;-1.9,6.36,;-.56,5.59,;.77,6.36,;4.68,3.91,;6.02,3.14,;7.35,3.91,;7.35,5.45,;8.68,6.22,;6.02,6.22,;4.68,5.45,)|