Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499643
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
1.20±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:
BDBM499643
Synonyms:
US11020395, Example 241.0
Type:
Small organic molecule
Emp. Form.:
C23H29ClN6O5S
Mol. Mass.:
537.032
SMILES:
CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(C2CCCC2)n1-c1c(OC)cccc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,(4.53,-3.92,;3.2,-3.15,;3.2,-1.61,;1.87,-.84,;1.87,.7,;.53,-1.61,;-.24,-2.94,;1.3,-2.94,;-.8,-.84,;-2.13,-1.61,;-2.61,-3.07,;-4.15,-3.07,;-4.63,-1.61,;-6.17,-1.61,;-7.07,-.36,;-8.54,-.84,;-8.54,-2.38,;-7.07,-2.85,;-3.38,-.7,;-3.38,.84,;-4.71,1.61,;-6.05,.84,;-7.38,1.61,;-4.71,3.15,;-3.38,3.92,;-2.05,3.15,;-2.05,1.61,;-.71,.84,;.62,1.61,;4.53,-.84,;5.87,-1.61,;7.2,-.84,;7.2,.7,;8.54,1.47,;5.87,1.47,;4.53,.7,)|