Reaction Details Report a problem with these data
Target
G-protein coupled receptor 4
Ligand
BDBM123511
Substrate
n/a
Meas. Tech.
Radio Ligand Binding Assay
pH
8±n/a
IC50
5±n/a nM
Citation
 Miltz, W; Oberhauser, B; Vaupel, A; Velcicky, J; Weigand, K; Leleti, RR; Liu, Y; Du, Z Pyrazolo pyrimidine derivatives US Patent  US8748435 Publication Date 6/10/2014 
Target
Name:
G-protein coupled receptor 4
Synonyms:
G-protein coupled receptor 4 | G-protein coupled receptor 4 (GPR4) | GPR4 | GPR4_HUMAN
Type:
Enzyme
Mol. Mass.:
40994.40
Organism:
Homo sapiens (Human)
Description:
P46093
Residue:
362
Sequence:
MGNHTWEGCHVDSRVDHLFPPSLYIFVIGVGLPTNCLALWAAYRQVQQRNELGVYLMNLSIADLLYICTLPLWVDYFLHHDNWIHGPGSCKLFGFIFYTNIYISIAFLCCISVDRYLAVAHPLRFARLRRVKTAVAVSSVVWATELGANSAPLFHDELFRDRYNHTFCFEKFPMEGWVAWMNLYRVFVGFLFPWALMLLSYRGILRAVRGSVSTERQEKAKIKRLALSLIAIVLVCFAPYHVLLLSRSAIYLGRPWDCGFEERVFSAYHSSLAFTSLNCVADPILYCLVNEGARSDVAKALHNLLRFLASDKPQEMANASLTLETPLTSKRNSTAKAMTGSWAATPPSQGDQVQLKMLPPAQ
  
Inhibitor
Name:
BDBM123511
Synonyms:
US8748435, 36
Type:
Small organic molecule
Emp. Form.:
C25H30N6O
Mol. Mass.:
430.5453
SMILES:
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(cc1)-c1nnc(o1)[C@H]1CC[C@H](N)CC1 |r,wU:25.28,wD:28.32,(-6.74,4.11,;-7.83,3.02,;-7.43,1.53,;-8.33,.29,;-7.43,-.96,;-7.75,-2.47,;-9.24,-2.86,;-6.6,-3.5,;-5.14,-3.02,;-4.05,-4.11,;-4.82,-1.51,;-5.96,-.48,;-5.96,1.06,;-4.63,1.83,;-3.3,1.06,;-3.3,-.48,;-1.96,-1.25,;-.63,-.48,;-.63,1.06,;-1.96,1.83,;.71,-1.25,;.71,-2.79,;2.17,-3.27,;3.08,-2.02,;2.17,-.78,;4.62,-2.02,;5.39,-.69,;6.93,-.69,;7.7,-2.02,;9.24,-2.02,;6.93,-3.36,;5.39,-3.36,)|
Structure:
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