Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499534
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
1500±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:
BDBM499534
Synonyms:
US11020395, Example 130.0 | US11020395, Example 131.0
Type:
Small organic molecule
Emp. Form.:
C20H31ClN6O6S
Mol. Mass.:
519.015
SMILES:
COCC(COC)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1[C@H]1C[C@H](CO)C1 |r,wU:13.13,15.15,28.29,wD:30.32,(-5.34,3.92,;-4.01,3.15,;-4.01,1.61,;-2.67,.84,;-1.34,1.61,;-1.34,3.15,;-.01,3.92,;-2.67,-.7,;-1.43,-1.61,;-.09,-.84,;1.24,-1.61,;-.09,-2.38,;2.57,-2.38,;2.57,-.84,;2.57,.7,;3.91,-1.61,;3.91,-3.15,;5.24,-3.92,;5.24,-.84,;6.57,-1.61,;7.91,-.84,;7.91,.7,;9.24,1.47,;6.57,1.47,;5.24,.7,;-1.9,-3.07,;-3.44,-3.07,;-3.92,-1.61,;-5.38,-1.13,;-6.76,-1.83,;-7.46,-.46,;-8.92,.02,;-9.24,1.52,;-6.08,.24,)|