Reaction Details Report a problem with these data
Target
Prepronociceptin
Ligand
BDBM464459
Substrate
n/a
Meas. Tech.
Receptor Binding Assay
Ki
205±n/a nM
Citation
 Kuehnert, S; Koenigs, RM; Jakob, F; Kless, A; Wegert, A; Ratcliffe, P; Jostock, R; Koch, T; Linz, K; Schroeder, W 3-((hetero-)aryl)-8-amino-2-oxo-1,3-diaza-spiro-[4.5]-decane derivatives US Patent  US10793528 Publication Date 10/6/2020 
Target
Name:
Prepronociceptin
Synonyms:
OFQ | PNOC | PNOC_HUMAN
Type:
Protein
Mol. Mass.:
20301.31
Organism:
Human
Description:
Q13519
Residue:
176
Sequence:
MKVLLCDLLLLSLFSSVFSSCQRDCLTCQEKLHPALDSFDLEVCILECEEKVFPSPLWTPCTKVMARSSWQLSPAAPEHVAAALYQPRASEMQHLRRMPRVRSLFQEQEEPEPGMEEAGEMEQKQLQKRFGGFTGARKSARKLANQKRFSEFMRQYLVLSMQSSQRRRTLHQNGNV
  
Inhibitor
Name:
BDBM464459
Synonyms:
US10793528, Example SC_5029
Type:
Small organic molecule
Emp. Form.:
C24H36N4O3
Mol. Mass.:
428.5676
SMILES:
CNC(=O)CCN1C[C@]2(CC[C@@](CC2)(NC)c2ccccc2)N(CC2(O)CCC2)C1=O |r,wU:8.23,11.14,(-7.54,3.16,;-6.29,2.25,;-4.89,2.88,;-4.73,4.41,;-3.64,1.98,;-2.24,2.6,;-.99,1.7,;.48,2.17,;1.38,.93,;2.15,-.41,;3.69,-.41,;4.46,.93,;3.69,2.26,;2.15,2.26,;5.23,2.26,;4.46,3.59,;5.23,-.41,;4.46,-1.74,;5.23,-3.07,;6.77,-3.07,;7.54,-1.74,;6.77,-.41,;.48,-.32,;.95,-1.78,;-.14,-2.87,;1.29,-3.46,;-1.68,-2.87,;-1.68,-4.41,;-.14,-4.41,;-.99,.16,;-2.24,-.75,)|
Structure:
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