Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499567
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
0.540±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:
BDBM499567
Synonyms:
US11020395, Example 164.0 | US11020395, Example 165.0
Type:
Small organic molecule
Emp. Form.:
C20H24Cl2N8O5S
Mol. Mass.:
559.426
SMILES:
CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc([C@@H]2C[C@H](Cl)C2)n1-c1c(OC)ncnc1OC)c1ncc(Cl)cn1 |r,wU:3.3,2.1,wD:13.12,15.15,(2.26,4.6,;1.35,3.36,;-.18,3.52,;-1.08,2.27,;-2.61,2.43,;-.46,.87,;-1.86,.24,;.95,1.49,;.17,-.54,;-.73,-1.79,;-2.27,-1.79,;-2.75,-3.25,;-1.5,-4.16,;-1.5,-5.7,;-.42,-6.79,;-1.5,-7.87,;-1.5,-9.41,;-2.59,-6.79,;-.26,-3.25,;1.21,-3.73,;2.35,-2.7,;2.03,-1.19,;3.17,-.16,;3.81,-3.17,;4.14,-4.68,;2.99,-5.71,;1.53,-5.23,;.38,-6.26,;-.98,-5.54,;-.8,4.93,;-2.34,5.09,;-2.96,6.49,;-2.06,7.74,;-2.68,9.15,;-.52,7.58,;.1,6.17,)|