Reaction Details Report a problem with these data
Target
Transporter
Ligand
BDBM86748
Substrate
n/a
Ki
>10000±n/a nM
Comments
PDSP_7576
Citation
 Deecher, DC; Beyer, CE; Johnston, G; Bray, J; Shah, S; Abou-Gharbia, M; Andree, TH Desvenlafaxine succinate: A new serotonin and norepinephrine reuptake inhibitor. J Pharmacol Exp Ther 318:657-65 (2006) [PubMed]  Article 
Target
Name:
Transporter
Synonyms:
SLC6A3
Type:
Enzyme Catalytic Domain
Mol. Mass.:
68216.01
Organism:
GUINEA PIG
Description:
H0WCX4
Residue:
619
Sequence:
MSGRRCPVGLTSSVVAPAKEPNAMGPREVELVLVKEQNGVQLTNSTLISAPHSPTGAQERETWGKKIDFLLSVIGFAVDLANVWRFPYLCYKNGGGAFLVPYLLFMVIAGMPLFYMELALGQFNREGAAGVWKICPILKGVGFTVILISLYVGFFYNVIIAWALHYFFSSFSVELPWTHCNNTWNSPNCSDAPSGNASTGPGLNSTFGTTPAAEYFERGVLHLHLSHGIDDLGPPRWQLTACLVLVIVLLYFSLWKGVKTSGKVVWITATMPYVVLTALLLRGLTLPGAIDGIRAYLSVDFYRLCEASVWIDAATQVCFSLGVGFGVLIAFSSYNQFTNNCYRDAILTTSINSLTSFSSGFVVFSFLGYMAQKHSVPIGDVAKDGPGLIFIIYPEAIATLPLSSAWAVVFFIMLLTLGLDSAMGGMESVITGLIDEFQLLHRHRELFTLCIVLGTFLLSLFCVTNGGIYVFTLLDHFAAGTSILFGVLIEAIGVAWFYGVRQFSEDIKQMTGRRPSLYWRLCWKLVSPCFLLFVVVVSVVTFRPPHYGSYVFPAWANALGWAVAASSMAMVPIYAAYKFCSLPGSFREKLAQAITPEKDRELVNRGEVRQFTLRHWLLV
  
Inhibitor
Name:
BDBM86748
Synonyms:
CAS_386750-22-7 | Desvenlafaxine | NSC_6918664 | O-Desmethylvenlafaxine | US9944618, Compound ID No. 181
Type:
Small organic molecule
Emp. Form.:
C16H25NO2
Mol. Mass.:
263.3752
SMILES:
CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1
Structure:
Search PDB for entries with ligand similarity: