Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM507170
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding
EC50
23.0±n/a nM
Citation
 Chen, N; Chen, X; Chen, Y; Cheng, AC; Connors, RV; Deignan, J; Dransfield, PJ; Du, X; Fu, Z; Harvey, JS; Heath, JA; Heumann, LV; Horne, DB; Houze, J; Kaller, MR; Kayser, F; Khakoo, AY; Kopecky, DJ; Lai, S; Ma, Z; Medina, JC; Mihalic, JT; Nishimura, N; Olson, SH; Pattaropong, V; Swaminath, G; Wang, X; Wanska, M; Yang, K; Yeh, W Heteroaryl-substituted triazoles as APJ receptor agonists US Patent  US11046680 Publication Date 6/29/2021 
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:
BDBM507170
Synonyms:
US11046680, Example 41.0 | US11046680, Example 49.0 | US11046680, Example 50.0
Type:
Small organic molecule
Emp. Form.:
C20H21FN8O5S
Mol. Mass.:
504.495
SMILES:
COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)Cc2ncc(F)cn2)nnc1-c1nnc(C)o1 |r,wD:16.17,(1.83,-3.61,;.62,-4.67,;-.85,-4.15,;-1.15,-2.68,;-2.63,-2.2,;-3.74,-3.22,;-3.44,-4.7,;-4.62,-5.75,;-6.09,-5.33,;-2,-5.21,;-1.58,-7.16,;-.16,-7.79,;1.16,-7.01,;2.49,-7.79,;3.84,-8.58,;1.73,-9.15,;3.3,-6.47,;2.7,-5.42,;4.83,-6.47,;5.59,-5.12,;4.8,-3.79,;5.62,-2.44,;7.15,-2.47,;7.94,-1.11,;7.94,-3.76,;7.15,-5.12,;-.34,-9.33,;-1.85,-9.66,;-2.6,-8.34,;-4.16,-8.13,;-4.92,-6.8,;-6.45,-7.13,;-6.6,-8.64,;-7.96,-9.42,;-5.19,-9.33,)|
Structure:
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