Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM499483
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
9.40±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:
BDBM499483
Synonyms:
US11020395, Example 5.0
Type:
Small organic molecule
Emp. Form.:
C23H32N8O4S
Mol. Mass.:
516.616
SMILES:
COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)nnc1C1CCCCC1 |r,wU:16.17,18.19,(.9,1.41,;-.43,.64,;-1.77,1.41,;-1.77,2.95,;-3.1,3.72,;-4.44,2.95,;-4.44,1.41,;-5.77,.64,;-7.1,1.41,;-3.1,.64,;-3.1,-.9,;-1.86,-1.81,;-.37,-1.41,;.97,-2.18,;-.37,-2.95,;2.3,-2.95,;2.3,-1.41,;2.3,.13,;3.63,-2.18,;3.63,-3.72,;4.97,-1.41,;6.3,-2.18,;7.63,-1.41,;7.63,.13,;8.97,.9,;6.3,.9,;4.97,.13,;-2.33,-3.27,;-3.87,-3.27,;-4.35,-1.81,;-5.89,-1.81,;-6.66,-.47,;-8.2,-.47,;-8.97,-1.81,;-8.2,-3.14,;-6.66,-3.14,)|