Reaction Details Report a problem with these data
Target
Apelin receptor
Ligand
BDBM270030
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding Assay
pH
7.5±n/a
EC50
20.0±n/a nM
Comments
extracted
Citation
 Chen, N; Chen, X; Chen, Y; Fu, Z; Heath, JA; Horne, DB; Kaller, MR; Khakoo, AY; Kopecky, DJ; Ma, Z; Mihalic, JT; Swaminath, G; Wang, X; Yeh, W Methods of treating heart failure US Patent  US10058550 Publication Date 8/28/2018 
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:
BDBM270030
Synonyms:
(1S,2R)—N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-4H-1,2,4-triazol-3-yl)-1-ethoxy-1-(5-methyl-2-pyrazinyl)-2-propanesulfonamide or (1R,2S)—N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-4H-1,2,4-triazol-3-yl)-1-ethoxy-1-(5-methyl-2-pyrazinyl)-2-propanesulfonamide | US10058550, Example 588.0 | US10058550, Example 589.0
Type:
Small organic molecule
Emp. Form.:
C26H31N7O6S
Mol. Mass.:
569.633
SMILES:
CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1cnc(C)cn1 |r,wD:4.4,3.2,(3.48,.48,;1.95,.31,;1.04,1.56,;-.49,1.4,;-1.4,2.65,;-2.93,2.48,;-.77,4.05,;-2.18,4.68,;.64,3.43,;-.14,5.46,;-1.05,6.7,;-2.59,6.7,;-3.06,8.17,;-1.82,9.07,;-1.82,10.61,;-.48,11.38,;-.48,12.92,;-1.82,13.69,;-3.15,12.92,;-4.49,13.69,;-5.82,12.92,;-3.15,11.38,;-.57,8.17,;.89,8.65,;2.04,7.61,;1.72,6.11,;2.86,5.08,;3.5,8.09,;3.82,9.6,;2.68,10.63,;1.21,10.15,;.07,11.18,;.39,12.69,;-1.12,-.01,;-.21,-1.25,;-.84,-2.66,;-2.37,-2.82,;-3,-4.23,;-3.27,-1.58,;-2.65,-.17,)|
Structure:
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