Reaction Details Report a problem with these data
Target
High affinity choline transporter 1
Ligand
BDBM50416506
Substrate
n/a
Meas. Tech.
ChEMBL_644789 (CHEMBL1211032)
Ki
521.19±n/a nM
Citation
 Geldenhuys, WJ; Allen, DD; Lockman, PR 3-D-QSAR and docking studies on the neuronal choline transporter. Bioorg Med Chem Lett 20:4870-7 (2010) [PubMed]  Article 
Target
Name:
High affinity choline transporter 1
Synonyms:
Choline transporter | Cht1 | SC5A7_MOUSE | Slc5a7
Type:
PROTEIN
Mol. Mass.:
63358.06
Organism:
Mus musculus
Description:
ChEMBL_644789
Residue:
580
Sequence:
MSFHVEGLVAIILFYLLIFLVGIWAAWKTKNSGNPEERSEAIIVGGRDIGLLVGGFTMTATWVGGGYINGTAEAVYGPGCGLAWAQAPIGYSLSLILGGLFFAKPMRSKGYVTMLDPFQQIYGKRMGGLLFIPALMGEMFWAAAIFSALGATISVIIDVDVNISVIVSALIAILYTLVGGLYSVAYTDVVQLFCIFIGLWISVPFALSHPAVTDIGFTAVHAKYQSPWLGTIESVEVYTWLDNFLLLMLGGIPWQAYFQRVLSSSSATYAQVLSFLAAFGCLVMALPAICIGAIGASTDWNQTAYGYPDPKTKEEADMILPIVLQYLCPVYISFFGLGAVSAAVMSSADSSILSASSMFARNIYQLSFRQNASDKEIVWVMRITVLVFGASATAMALLTKTVYGLWYLSSDLVYIIIFPQLLCVLFIKGTNTYGAVAGYIFGLFLRITGGEPYLYLQPLIFYPGYYSDKNGIYNQRFPFKTLSMVTSFFTNICVSYLAKYLFESGTLPPKLDVFDAVVARHSEENMDKTILVRNENIKLNELAPVKPRQSLTLSSTFTNKEALLDVDSSPEGSGTEDNLQ
  
Inhibitor
Name:
BDBM50416506
Synonyms:
CHEMBL1209581
Type:
Small organic molecule
Emp. Form.:
C8H14NO
Mol. Mass.:
140.2023
SMILES:
C[N+]12CCC(CC1)C(=O)C2 |TLB:8:7:2.3:6.5,(9,-9.87,;9.05,-8.27,;9.32,-6.3,;8.86,-5.15,;8.78,-6.85,;7.26,-7.52,;7.46,-8.95,;10.19,-7.48,;11.34,-6.56,;10.48,-8.92,)|
Structure:
Search PDB for entries with ligand similarity: