Reaction Details
Report a problem with these data
Report a problem with these dataTarget
Apelin receptor
Ligand
BDBM360130
Substrate
n/a
Meas. Tech.
[35S]GTPgammaS Binding Assay
EC50
42.0±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:
BDBM360130
Synonyms:
(2R,3S)-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-4H-1,2,4-triazol-3- | US10221162, Example 433.0
Type:
Small organic molecule
Emp. Form.:
C28H43N5O6SSi
Mol. Mass.:
605.821
SMILES:
COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@H](O)C(C)(C)C)n1-c1c(OC)cccc1OC |r,wD:22.23,24.25,(-18.06,-10.79,;-16.53,-10.95,;-15.63,-9.71,;-16.25,-8.3,;-15.35,-7.05,;-13.82,-7.21,;-13.19,-8.62,;-14.09,-9.87,;-11.66,-8.78,;-10.89,-10.12,;-9.38,-9.8,;-9.22,-8.26,;-7.89,-7.49,;-7.89,-5.95,;-6.55,-5.18,;-6.55,-3.64,;-5.22,-2.87,;-7.89,-2.87,;-6.55,-2.1,;-6.55,-8.26,;-5.78,-6.93,;-7.32,-9.6,;-5.22,-9.03,;-5.22,-10.57,;-3.89,-8.26,;-3.89,-6.72,;-2.55,-9.03,;-1.22,-8.26,;-2.55,-10.57,;-1.22,-9.8,;-10.63,-7.64,;-10.95,-6.13,;-12.41,-5.66,;-13.56,-6.69,;-15.02,-6.21,;-12.73,-4.15,;-11.59,-3.12,;-10.12,-3.59,;-9.8,-5.1,;-8.34,-5.58,;-7.19,-4.55,)|
Structure:
