Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499540
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
340±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:
BDBM499540
Synonyms:
US11020395, Example 136.0 | US11020395, Example 137.0
Type:
Small organic molecule
Emp. Form.:
C18H27ClN6O4S
Mol. Mass.:
458.963
SMILES:
CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@H]2C[C@H](CO)C2)n1C(C)C)c1ncc(Cl)cn1 |r,wU:3.3,15.15,2.1,wD:13.12,(3.49,5.16,;2.59,3.92,;1.06,4.08,;.15,2.83,;-1.38,2.99,;.78,1.43,;-.63,.8,;2.18,2.05,;1.4,.02,;.5,-1.23,;-1.04,-1.23,;-1.52,-2.69,;-.27,-3.6,;-.27,-5.14,;-1.36,-6.23,;-.27,-7.32,;-.27,-8.86,;1.06,-9.63,;.82,-6.23,;.97,-2.69,;2.44,-3.17,;3.58,-2.14,;2.76,-4.67,;.43,5.48,;-1.1,5.65,;-1.73,7.05,;-.82,8.3,;-1.45,9.71,;.71,8.14,;1.33,6.73,)|