Drug General Information
Drug ID
DXS2AX
Drug Name
1-{(3R,3aR)-3-[3-(4-acetyl-piperazin-1-yl)-propyl]-8-fluoro-3-phenyl-3a,4-dihydro-3H-5-oxa-1,9b-diaza-cyclopenta[a]naphthalen-2-yl}-ethanone
Synonyms
CHEMBL250125
Indication Discovery agent Investigative [1587926]
Formula
C27H31FN4O3
Canonical SMILES
CC(=O)N1CCN(CCC[C@]2([C@@H]3COc4ccc(F)cc4N3N=C2C(=O)C)c5ccccc5)CC1
InChI
InChI=1S/C27H31FN4O3/c1-19(33)26-27(21-7-4-3-5-8-21,11-6-12-30-13-15-31(16-14-30)20(2)34)25-18-35-24-10-9-22(28)17-23(24)32(25)29-26/h3-5,7-10,17,25H,6,11-16,18H2,1-2H3/t25-,27+/m0/s1
InChIKey
BWKAHABETZLDBG-AHKZPQOWSA-N
Target and Pathway
Target(s) Kinesin-like protein KIF11 Target Info [1587926]
mRNA of kinesin spindle protein Target Info [1587926]
Reactome MHC class II antigen presentation
KinesinsR-HSA-2132295:MHC class II antigen presentation
Kinesins
WikiPathways MHC class II antigen presentation
KinesinsWP2679:MHC class II antigen presentation
Kinesins
References
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017

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