Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499500
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
50.0±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:
BDBM499500
Synonyms:
US11020395, Example 82.0
Type:
Small organic molecule
Emp. Form.:
C21H28N8O5S
Mol. Mass.:
504.563
SMILES:
CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCC2)n1-c1c(OC)ncnc1OC)c1cnc(C)cn1 |r,wU:3.3,2.1,(4.44,-3.92,;3.1,-3.15,;3.1,-1.61,;1.77,-.84,;1.77,.7,;.44,-1.61,;-.33,-2.94,;1.21,-2.94,;-.9,-.84,;-2.23,-1.61,;-2.71,-3.07,;-4.25,-3.07,;-4.72,-1.61,;-6.26,-1.61,;-7.35,-.52,;-8.44,-1.61,;-7.35,-2.7,;-3.48,-.7,;-3.48,.84,;-4.81,1.61,;-6.14,.84,;-7.48,1.61,;-4.81,3.15,;-3.48,3.92,;-2.14,3.15,;-2.14,1.61,;-.81,.84,;.53,1.61,;4.44,-.84,;4.44,.7,;5.77,1.47,;7.11,.7,;8.44,1.47,;7.11,-.84,;5.77,-1.61,)|