Details of the Competitor

General Information of Competitor

Competitor ID
LDCM0095
Competitor Name
DC-LC3IN-D5
Synonyms
DC-LC3in-D5; 2868312-73-4; MS-26700; HY-141882; CS-0312206
Structure
3D MOL 2D MOL
Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 397.3
Lipid-water partition coefficient (xlogp) 2.4
Rotatable Bond Count (rotbonds) 5
Hydrogen Bond Donor Count (hbonddonor) 1
Hydrogen Bond Acceptor Count (hbondacc) 5
Chemical Identifiers
Formula
C19H22Cl2N2O3
IUPAC Name
5-(2,3-dichlorophenyl)-3-hydroxy-2-(2-morpholin-4-ylethyliminomethyl)cyclohex-2-en-1-one
Canonical SMILES
C1COCCN1CCN=CC2=C(CC(CC2=O)C3=C(C(=CC=C3)Cl)Cl)O
InChI
InChI=1S/C19H22Cl2N2O3/c20-16-3-1-2-14(19(16)21)13-10-17(24)15(18(25)11-13)12-22-4-5-23-6-8-26-9-7-23/h1-3,12-13,24H,4-11H2
InChIKey
IYDBJXOPTZDWCZ-UHFFFAOYSA-N

The Competitor Interaction Atlas

Probe(s) Related This Competitor

ABPP Probe
Click To Hide/Show 1 Probe Related to This Competitor
Probe Name Structure Concentration Cell-system Ref
D5yne
 Probe Info  		5 uM Human endocervical adenocarcinoma cells (HeLa) [1]

Target(s) List of this Competitor

6 Enzyme Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
3-ketodihydrosphingosine reductase (KDSR) LDTP05476 2.69  LDD0055 
Casein kinase II subunit alpha' (CSNK2A2) LDTP03011 1.65  LDD0055 
Epoxide hydrolase 1 (EPHX1) LDTP02175 2.56  LDD0055 
Phosphoglucomutase-1 (PGM1) LDTP03818 1.90  LDD0055 
Polypeptide N-acetylgalactosaminyltransferase 2 (GALNT2) LDTP05623 1.98  LDD0055 
Serum paraoxonase/arylesterase 2 (PON2) LDTP06333 7.53  LDD0055 
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⏷ Show the Full List of 6 Enzyme
2 Transporter and channel Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
Interferon-induced transmembrane protein 3 (IFITM3) LDTP05302 1.65  LDD0055 
Lysosome membrane protein 2 (SCARB2) LDTP06034 11.37  LDD0055 
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8 Other Competed by This Competitor
Target Name Target ID Binding Ratio Interaction ID
Glycolipid transfer protein (GLTP) LDTP12891 3.73  LDD0055 
Large ribosomal subunit protein P2 (RPLP2) LDTP02108 1.66  LDD0055 
Microtubule-associated proteins 1A/1B light chain 3B (MAP1LC3B) LDTP11637 100.00  LDD0055 
Nicastrin (NCSTN) LDTP09787 1.66  LDD0055 
Protein jagunal homolog 1 (JAGN1) LDTP08904 1.58  LDD0055 
Syntaxin-12 (STX12) LDTP08389 2.26  LDD0055 
Syntaxin-7 (STX7) LDTP00632 3.76  LDD0055 
Transmembrane protein 43 (TMEM43) LDTP11210 1.52  LDD0055 
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⏷ Show the Full List of 8 Other

Full Information of The Labelling Profiles of This Competitor

Quantification: Probe vs (Probe+Competitor)
  
Experiment 1 Reporting the Labelling Profiles of This Probe
REF [1]
Probe concentration 5 uM
Quantitative Method LFQ
Competitor Name DC-LC3IN-D5
Competitor Concentration 25 uM
In Vitro Experiment Model Model Type
Living cell
Derived Tissue
Cervix uteri
Disease Model Endocervical adenocarcinoma [ICD-11:2C77]
Model Name Human endocervical adenocarcinoma cells (HeLa)
Interaction Atlas ID  LDD0055  Download The Altas

References

1 Inhibition of Autophagy by a Small Molecule through Covalent Modification of the LC3 Protein. Angew Chem Int Ed Engl. 2021 Dec 6;60(50):26105-26114. doi: 10.1002/anie.202109464. Epub 2021 Nov 5.
Mass spectrometry data entry: PXD026874