Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499640
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
120±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:
BDBM499640
Synonyms:
US11020395, Example 238.0
Type:
Small organic molecule
Emp. Form.:
C22H29ClN8O7S
Mol. Mass.:
585.033
SMILES:
CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC(C2)(OC)OC)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(5.75,-3.92,;4.42,-3.15,;4.42,-1.61,;3.09,-.84,;3.09,.7,;1.75,-1.61,;.98,-2.94,;2.52,-2.94,;.42,-.84,;-.92,-1.61,;-1.39,-3.07,;-2.93,-3.07,;-3.41,-1.61,;-4.95,-1.61,;-6.04,-.52,;-7.13,-1.61,;-6.04,-2.7,;-8.21,-.52,;-9.75,-.52,;-8.21,-2.7,;-9.75,-2.7,;-2.16,-.7,;-2.16,.84,;-3.49,1.61,;-4.83,.84,;-6.16,1.61,;-3.49,3.15,;-2.16,3.92,;-.83,3.15,;-.83,1.61,;.51,.84,;1.84,1.61,;5.75,-.84,;7.09,-1.61,;8.42,-.84,;8.42,.7,;9.75,1.47,;7.09,1.47,;5.75,.7,)|