Bioactive Compound Details

BioIDbio3135
NameLATREPIRDINE
ChEMBL IDCHEMBL589390
Molecular FormulaC21H25N3
Molecular Weight319.45
Molecular Weight (Monoisotopic)319.2048
TypeSmall molecule
Max PhasePhase 3
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsDIMEBOLIN|DIMEBON|LATREPIRDINA|LATREPIRDINE|PF-01913539
SmilesCc1ccc2c(c1)c1c(n2CCc2ccc(C)nc2)CCN(C)C1
InchiInChI=1S/C21H25N3/c1-15-4-7-20-18(12-15)19-14-23(3)10-9-21(19)24(20)11-8-17-6-5-16(2)22-13-17/h4-7,12-13H,8-11,14H2,1-3H3
Inchi KeyJNODQFNWMXFMEV-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets86.0
Bioactivities1222.0
Np Likeness Score-1.06
Records Key['LATREPIRDINE', 'SID85146210', '3{1}, I, Dimebone, dimebolin', 'Dimebolin', 'Dimebolin', '1, latrepirdine', 'Dimebon', 'COVC-0677563373', '79', 'PF-1913539', 'SID104223880', 'LATREPIRDINE', '19, Latrepirdine', 'latrepirdine; Dimebon dihydrochloride', 'EUB0000480a', '11', '54', 'EUB0000480a', 'EUB0000480a', '6', 'EUB0000480a', 'EUB0000480a']
Records Name['LATREPIRDINE', 'SID85146210', '2,8-dimethyl-5-[2-(6-methylpyridin-3-yl)ethyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole', 'Dimebolin', 'Dimebolin', 'Dimebon', 'Dimebon', 'LATREPIRDINE', 'Dimebolin', '2,8-dimethyl-5-(2-(6-methylpyridin-3-yl)ethyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole', 'SID104223880', 'LATREPIRDINE', 'Dimebon', 'latrepirdine; Dimebon dihydrochloride', 'LATREPIRDINE', 'Latrepirdine', 'Latrepirdine', 'LATREPIRDINE', 'LATREPIRDINE', 'Dimebon; Dimebolin, Latrepirdine', 'LATREPIRDINE', 'LATREPIRDINE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure