Table of Contents
NFN1 0.1μM R01 exp49
Mechanism of Action
Nitrofuran derivative, candidate ALDH2 inhibitor
- Class / Subclass 1: Infectious Disease / Antibiotic
Technical Notes
Protein References
- PubChem Name: Ethyl 5-ethyl-2-[(5-nitrofuran-2-carbonyl)amino]thiophene-3-carboxylate
- Synonyms: N/A
- CAS #: 219620-36-7
- PubChem CID: 2799305
- IUPAC: ethyl 5-ethyl-2-[(5-nitrofuran-2-carbonyl)amino]thiophene-3-carboxylate
- INCHI Name: InChI=1S/C14H14N2O6S/c1-3-8-7-9(14(18)21-4-2)13(23-8)15-12(17)10-5-6-11(22-10)16(19)20/h5-7H,3-4H2,1-2H3,(H,15,17)
- INCHI Key: OASNGLRREXBINI-UHFFFAOYSA-N
- Molecular Weight: 338.34
- Canonical SMILES: CCC1=CC(=C(S1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])C(=O)OCC
- Isomeric SMILES: N/A
- Molecular Formula: C14H14N2O6S
Protein Supplier
- Supplier Name: Maybridge
- Catalog #: BTB05727SC
- Lot #: N/A
Protein Characterization
- HRMS (ESI-TOF) m/z: (M+H)+ Calcd for C14H14N2O6S 339.06453; found 339.0634
Dose Response Curve
- Platform ID: NFN1
- Min: -1.7682; Max: 66.1639
| IC | Concentration (µM) |
|---|---|
| IC10 | N/A |
| IC20 | 0.3734 |
| IC30 | 1.2393 |
| IC40 | 3.3135 |
| IC50 | 8.1701 |
| IC60 | N/A |
| IC70 | N/A |
| IC80 | N/A |
| IC90 | N/A |
Screen Summary
- Round: 01
- Dose: 100nM
- Days of incubation: 8
- Doublings: 6.7
- Numbers of reads: 12398986
Screen Results
| Sensitive/Resistant hits (FDR<0.05) | CRANKS | Score Plot | Top 30 Genes | Screen Similarity | Top 30 Sensitive GO terms | Top 30 Resistant GO terms |
|---|---|---|---|---|---|---|
| 0/0 | Scores |
NFN1 0.1μM R01 exp49
NFN1 0.1μM R01 exp49 vs YM155 0.0002μM R01 exp61
NFN1 0.1μM R01 exp49 vs Nifuroxazide 1μM R01 exp51
NFN1 0.1μM R01 exp49 vs UM131593 0.1μM R01 exp58
NFN1 0.1μM R01 exp49 vs Taxol 0.002μM R01 exp54
NFN1 0.1μM R01 exp49 vs Suberoylanilide-Hydroxamic-Acid 0.02μM R01 exp53
2-Methoxyestradiol 0.2μM R01 exp40 vs NFN1 0.1μM R01 exp49
BI-2536 0.001μM R01 exp41 vs NFN1 0.1μM R01 exp49
Lapatinib 5μM R01 exp47 vs NFN1 0.1μM R01 exp49
