Bioactive Compound Details

BioIDbio3147
NameDESLORATADINE
ChEMBL IDCHEMBL1172
Molecular FormulaC19H19ClN2
Molecular Weight310.83
Molecular Weight (Monoisotopic)310.1237
TypeSmall molecule
Max PhasePhase 4
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsAERIUS|ALLEX|AZOMYR|CLARINEX|DASSELTA|DENOSIN|DESCARBOETHOXYLORATADINE|DESLORATADINA|DESLORATADINE|DESLORATADINE ACTAVIS|DESLORATADINE TEVA|LORATADINE RELATED COMPOUND A|LORATADINE RELATED COMPOUND A RS|MIDETORIN|NSC-759824|Neoclarityn|OPULIS|SCH 34117|SCH-34117
SmilesClc1ccc2c(c1)CCc1cccnc1C2=C1CCNCC1
InchiInChI=1S/C19H19ClN2/c20-16-5-6-17-15(12-16)4-3-14-2-1-9-22-19(14)18(17)13-7-10-21-11-8-13/h1-2,5-6,9,12,21H,3-4,7-8,10-11H2
Inchi KeyJAUOIFJMECXRGI-UHFFFAOYSA-N
Molecular SpeciesBASE
Targets183.0
Bioactivities538.0
Np Likeness Score-0.25
Records Key['1a', 'Desloratadine', 'DESLORATADINE', 'SID26719697', 'SID26754458', 'SID29215232', 'Desloratadine', 'DESLORATADINE', '1', 'Desloratadine', '5', '44', 'DESLORATADINE', 'SID170464781', '3', 'DESLORATADINE', 'desloratadine', '1721', 'Desloratadine', 'SID144205127', 'SAM001246545', 'Desloratadine', '1', 'DESLORATIDINE', 'Desloratadine', 'DESLORATADINE', 'DESLORATADINE', 'COVC-0677412932', '4', '2', 'SID14742700', 'Desloratadine', 'Desloratadine', 'SID50086379', '2', 'Desloratadine', 'BDBM50073179', 'Desloratadine', 'M-1', 'DESLORATADINE', 'Desloratadine', 'BDBM50073179', 'DESLORATIDINE', 'DESLORATIDINE', 'Desloratadine', 'DESLORATIDINE', 'DESLORATADINE', 'DLT', 'desloratadine', 'BA1001121']
Records Name['8-Chloro-11-piperidin-4-ylidene-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine', 'Desloratadine', 'DESLORATADINE', 'SID26719697', 'SID26754458', 'SID29215232', 'Desloratadine', 'Desloratadine', 'Desloratadine', '8-Chloro-11-piperidin-4-ylidene-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine', 'Desloratadine', 'Desloratadine', 'DESLORATADINE', 'SID170464781', 'Desloratadine', 'DESLORATADINE', 'desloratadine', None, 'Desloratadine', 'SID144205127', 'C0164735', 'Desloratadine', '8-Chloro-11-piperidin-4-ylidene-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine', 'DESLORATIDINE', 'Desloratadine', 'DESLORATADINE', 'DESLORATADINE', 'DESLORATADINE', '8-Chloro-11-(piperidin-4-ylidene)-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine', 'Desloratadine', 'SID14742700', 'Desloratadine', 'Desloratadine', 'SID50086379', 'Desloratadine', 'Desloratadine', '8-Chloro-11-piperidin-4-ylidene-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine::CHEMBL1172::Clarinex::Claritin::Claritin-D::DESLORATADINE::SCH-34117::US9138431, DESLORATADINE (Clarinex)::US9333199, DESLORATADINE (Clarinex)', 'Desloratadine', 'Desloratadine', 'DESLORATADINE', 'Desloratadine', '8-Chloro-11-piperidin-4-ylidene-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine::CHEMBL1172::Clarinex::Claritin::Claritin-D::DESLORATADINE::SCH-34117::US9138431, DESLORATADINE (Clarinex)::US9333199, DESLORATADINE (Clarinex)', 'DESLORATIDINE', 'DESLORATIDINE', 'Desloratadine', 'DESLORATIDINE', 'DESLORATADINE', 'Desloratadine', 'desloratadine', 'DESLORATADINE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure