Target
Kappa-type opioid receptor
Ligand
BDBM50506108
Substrate
n/a
Meas. Tech.
ChEMBL_1824927 (CHEMBL4324691)
Ki
0.470000±n/a nM
Citation
 Xiao, LWang, YZhang, MWu, WKong, LMa, YXu, XLiu, XHe, QQian, YSun, HWu, HLin, CHuang, HYe, RJiang, SYe, RFYuan, CFang, SXue, DYang, XChen, HZheng, YYu, LXie, QZheng, LFu, WLi, WQiu, ZLiu, JShao, L Discovery of a Highly Selective and Potent ? Opioid Receptor Agonist from  J Med Chem 62:11054-11070 (2019) [PubMed]  Article 
Target
Name:
Kappa-type opioid receptor
Synonyms:
K-OR-1 | KOR-1 | Kappa-opioid receptor (KOR) | Kappa-type opioid receptor (KOPR) | Kappa-type opioid receptor (KOR) | Kappa-type opioid receptor (Kappa) | OPIATE Kappa | OPRK | OPRK1 | OPRK_HUMAN | kappa opioid receptor (KOR)
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
42648.76
Organism:
Homo sapiens (Human)
Description:
P41145
Residue:
380
Sequence:
MDSPIQIFRGEPGPTCAPSACLPPNSSAWFPGWAEPDSNGSAGSEDAQLEPAHISPAIPVIITAVYSVVFVVGLVGNSLVMFVIIRYTKMKTATNIYIFNLALADALVTTTMPFQSTVYLMNSWPFGDVLCKIVISIDYYNMFTSIFTLTMMSVDRYIAVCHPVKALDFRTPLKAKIINICIWLLSSSVGISAIVLGGTKVREDVDVIECSLQFPDDDYSWWDLFMKICVFIFAFVIPVLIIIVCYTLMILRLKSVRLLSGSREKDRNLRRITRLVLVVVAVFVVCWTPIHIFILVEALGSTSHSTAALSSYYFCIALGYTNSSLNPILYAFLDENFKRCFRDFCFPLKMRMERQSTSRVRNTVQDPAYLRDIDGMNKPV
  
Inhibitor
Name:
BDBM50506108
Synonyms:
CHEMBL4449252
Type:
Small organic molecule
Emp. Form.:
C37H40N2O4
Mol. Mass.:
576.7245
SMILES:
[H][C@@]12Oc3c4c(C[C@@]5([H])N(CC6CC6)CC[C@@]14[C@@]51CC[C@@]2(OC)[C@H](C1)c1ccc(NC(=O)c2ccccc2)cc1)ccc3OC |r,THB:10:9:17:4.5.6|
Structure:
Search PDB for entries with ligand similarity: