Reaction Details
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Report a problem with these dataTarget
Apelin receptor
Ligand
BDBM269909
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding Assay
EC50
2.50±n/a nM
Citation
Chen, N; Chen, X; Chen, Y; Cheng, AC; Connors, RV; Deignan, J; Dransfield, PJ; Du, X; Fu, Z; Heath, JA; Horne, DB; Houze, J; Kaller, MR; Khakoo, AY; Kopecky, DJ; Lai, S; Ma, Z; McGee, LR; Medina, JC; Mihalic, JT; Nishimura, N; Olson, SH; Pattaropong, V; Swaminath, G; Wang, X; Yang, K; Yeh, W; Debenedetto, MV; Farrell, RP; Hedley, SJ; Judd, TC; Kayser, F Triazole agonists of the APJ receptor US Patent US10221162 Publication Date 3/5/2019 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:
BDBM269909
Synonyms:
(1R,2S)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-4H-1,2,4-triazol-3-yl)-1-hydroxy-2-propanesulfonamide or (1S,2R)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-4H-1,2,4-triazol-3-yl)-1-hydroxy-2-propanesulfonamide | US10058550, Example 442.0 | US10058550, Example 443.0 | US10221162, Example 443.0 | US9845310, Example 443.0
Type:
Small organic molecule
Emp. Form.:
C25H33N5O6S
Mol. Mass.:
531.624
SMILES:
COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.96,-8.33,;-7.48,-8.73,;-6.39,-7.64,;-6.79,-6.16,;-5.7,-5.07,;-4.21,-5.47,;-3.81,-6.95,;-4.9,-8.04,;-2.32,-7.35,;-1.85,-8.82,;-.31,-8.82,;.17,-7.35,;1.5,-6.58,;2.84,-7.35,;2.07,-8.69,;3.61,-8.69,;4.17,-6.58,;4.17,-5.04,;5.5,-7.35,;5.5,-8.89,;6.84,-6.58,;8.17,-7.35,;9.5,-6.58,;9.5,-5.04,;8.17,-4.27,;6.84,-5.04,;-1.08,-6.45,;-1.08,-4.91,;-2.41,-4.14,;-3.74,-4.91,;-5.08,-4.14,;-2.41,-2.6,;-1.08,-1.83,;.26,-2.6,;.26,-4.14,;1.59,-4.91,;2.92,-4.14,)|
Structure:
