Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499494
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
11.0±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:
BDBM499494
Synonyms:
US11020395, Example 24.0
Type:
Small organic molecule
Emp. Form.:
C19H23ClN8O5S
Mol. Mass.:
510.955
SMILES:
CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CC2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.13,-4.06,;2.8,-3.29,;2.8,-1.75,;1.46,-.98,;1.46,.56,;.13,-1.75,;-1.2,-2.52,;1.46,-2.52,;-1.2,-.98,;-2.67,-1.46,;-3.14,-2.93,;-4.68,-2.93,;-5.16,-1.46,;-6.63,-.98,;-7.66,.16,;-8.13,-1.3,;-3.91,-.56,;-3.91,.98,;-2.58,1.75,;-1.25,.98,;.09,1.75,;-2.58,3.29,;-3.91,4.06,;-5.25,3.29,;-5.25,1.75,;-6.58,.98,;-7.92,1.75,;4.13,-.98,;5.46,-1.75,;6.8,-.98,;6.8,.56,;8.13,1.33,;5.46,1.33,;4.13,.56,)|