Reaction Details Report a problem with these data
Target
G protein-coupled receptor kinase 6
Ligand
BDBM375066
Substrate
n/a
Meas. Tech.
TBD
IC50
16890±n/a nM
Citation
 Stewart, AK; Plekhov, A; Greenhouse, R Inhibiting G protein coupled receptor 6 kinase polypeptides US Patent  US10252984 Publication Date 4/9/2019 
Target
Name:
G protein-coupled receptor kinase 6
Synonyms:
GPRK6 | GRK6 | GRK6_HUMAN
Type:
PROTEIN
Mol. Mass.:
66001.83
Organism:
Homo sapiens (Human)
Description:
ChEMBL_793895
Residue:
576
Sequence:
MELENIVANTVLLKAREGGGGNRKGKSKKWRQMLQFPHISQCEELRLSLERDYHSLCERQPIGRLLFREFCATRPELSRCVAFLDGVAEYEVTPDDKRKACGRQLTQNFLSHTGPDLIPEVPRQLVTNCTQRLEQGPCKDLFQELTRLTHEYLSVAPFADYLDSIYFNRFLQWKWLERQPVTKNTFRQYRVLGKGGFGEVCACQVRATGKMYACKKLEKKRIKKRKGEAMALNEKQILEKVNSRFVVSLAYAYETKDALCLVLTLMNGGDLKFHIYHMGQAGFPEARAVFYAAEICCGLEDLHRERIVYRDLKPENILLDDHGHIRISDLGLAVHVPEGQTIKGRVGTVGYMAPEVVKNERYTFSPDWWALGCLLYEMIAGQSPFQQRKKKIKREEVERLVKEVPEEYSERFSPQARSLCSQLLCKDPAERLGCRGGSAREVKEHPLFKKLNFKRLGAGMLEPPFKPDPQAIYCKDVLDIEQFSTVKGVELEPTDQDFYQKFATGSVPIPWQNEMVETECFQELNVFGLDGSVPPDLDWKGQPPAPPKKGLLQRLFSRQDCCGNCSDSEEELPTRL
  
Inhibitor
Name:
BDBM375066
Synonyms:
US10252984, Table 2.27
Type:
Small organic molecule
Emp. Form.:
C44H58N4O8
Mol. Mass.:
770.9533
SMILES:
CC(C)C1=C(O)C(=O)\C(=C/NCCCN2CCOCC2)c2c(O)c(c(C)cc12)-c1c(C)cc2C(C(C)C)=C(O)C(=O)\C(=C/NCCCN3CCOCC3)c2c1O |c:3,t:39,(-8.03,-6.67,;-6.49,-6.67,;-5.72,-8,;-5.72,-5.33,;-6.49,-4,;-8.03,-4,;-5.72,-2.67,;-6.49,-1.33,;-4.18,-2.67,;-3.41,-1.33,;-4.18,,;-3.41,1.33,;-4.18,2.67,;-3.41,4,;-4.18,5.33,;-3.41,6.67,;-4.18,8,;-5.72,8,;-6.49,6.67,;-5.72,5.33,;-3.41,-4,;-1.87,-4,;-1.1,-2.67,;-1.1,-5.33,;-1.87,-6.67,;-1.1,-8,;-3.41,-6.67,;-4.18,-5.33,;1.1,-5.33,;1.87,-6.67,;1.1,-8,;3.41,-6.67,;4.18,-5.33,;5.72,-5.33,;6.49,-6.67,;8.03,-6.67,;5.72,-8,;6.49,-4,;8.03,-4,;5.72,-2.67,;6.49,-1.33,;4.18,-2.67,;3.41,-1.33,;4.18,,;3.41,1.33,;4.18,2.67,;3.41,4,;4.18,5.33,;5.72,5.33,;6.49,6.67,;5.72,8,;4.18,8,;3.41,6.67,;3.41,-4,;1.87,-4,;1.1,-2.67,)|
Structure:
Search PDB for entries with ligand similarity: