Reaction Details Report a problem with these data
Target
Histamine receptor H3
Ligand
BDBM247450
Substrate
n/a
Meas. Tech.
Radioligand Binding Assay
Ki
112±n/a nM
Citation
 Gao, Z Substituted phenyl cycloalkyl pyrrolidine (piperidine) spirolactams and amides, preparation and therapeutic use thereof US Patent  US9453023 Publication Date 9/27/2016 
Target
Name:
Histamine receptor H3
Synonyms:
n/a
Type:
Enzyme
Mol. Mass.:
48611.84
Organism:
Macaca mulatta (Rhesus macaque)
Description:
Q865E1
Residue:
445
Sequence:
MERAPPDGPLNASGALAGEAAAAGGARGFSAAWTAVLAALMALLIVATVLGNALVMLAFVADSSLRTQNNFFLLNLAISDFLVGAFCIPLYVPYVLTGRWTFGRGLCKLWLVVDYLLCTSSAFNIVLISYDRFLSVTRAVSYRAQQGNTRRAVRKMLLVWVLAFLLYGPAILSWEYLSGGSSIPEGHCYAEFFYNWYFLITASTLEFFTPFLSVTFFNLSIYLNIQRRTRLRLDGAREAGGPEPPPEAQPSPPPPPGCWGCWQKGHGEAMPLHRYGVGEAAAGAEAGETALGGGGGGGSAASPTSSSGSSSRGTERPRSLKRGSKPSASSASLEKRMKMVSQSFTQRFRLSRDRKVAKSLAVIVSIFGLCWAPYTLLMIIRAACHGHCVPDYWYETSFWLLWANSAVNPVLYPLCHHSFRRAFTKLLCPQKLKIQPHSSLEQCWK
  
Inhibitor
Name:
BDBM247450
Synonyms:
US9453023, 9
Type:
Small organic molecule
Emp. Form.:
C24H34N2O2
Mol. Mass.:
382.539
SMILES:
O=C1N(CCC11CCOCC1)c1ccc(cc1)[C@H]1CC[C@@H](CC1)N1CCCC1 |r,wU:17.19,wD:20.26,(-4.12,1.4,;-4.89,.07,;-4.41,-1.4,;-5.66,-2.3,;-6.9,-1.4,;-6.43,.07,;-5.66,1.4,;-6.43,2.73,;-7.97,2.73,;-8.74,1.4,;-7.97,.07,;-2.87,-1.4,;-2.1,-2.73,;-.56,-2.73,;.21,-1.4,;-.56,-.07,;-2.1,-.07,;1.75,-1.4,;2.52,-.07,;4.06,-.07,;4.83,-1.4,;4.06,-2.73,;2.52,-2.73,;6.37,-1.4,;7.27,-2.65,;8.74,-2.17,;8.74,-.63,;7.27,-.15,)|
Structure:
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