Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | SDHB | P21912 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.35 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.35 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.35 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Metacresol SCHEMBL28388432 | 0.80 | ACHE (0.63) | ACHELMNAPTPN5CYP1A2CYP3A4 | |
| Trifluoromethanesulfonic Acid SCHEMBL30037873 | 0.79 | ACHE (0.38) | ACHEPTPN5CYP1A2CYP3A4CYP2C9 | |
| Trifluoromethanesulfonic Acid SCHEMBL3354312 | 0.78 | CES2 (0.46) | SMN1; SMN2CYP1A2CYP3A4CYP2C19PARP1 | |
| SCHEMBL1735 | 0.78 | — | — | |
| SCHEMBL29669690 | 0.78 | — | — | |
| SCHEMBL3354260 | 0.77 | ALDH1A1 (0.46) | LMNASMN1; SMN2L3MBTL1KMT2AMEN1 | |
| Trifluoromethanesulfonic Acid SCHEMBL3347804 | 0.77 | CA2 (0.42) | ACHELMNAPTGS2KMT2AMEN1 | |
| Trifluoromethanesulfonic Acid SCHEMBL8736573 | 0.77 | PTPN5 (0.43) | SMN1; SMN2PTPN5L3MBTL1PTPN1SDHB | |
| Trifluoromethanesulfonic Acid SCHEMBL180454 | 0.77 | TSHR (0.50) | ACHELMNASMN1; SMN2CYP1A2CYP3A4 | |
| Trifluoromethanesulfonic Acid SCHEMBL3347579 | 0.77 | PTPN1 (0.42) | LMNAPMP22SMN1; SMN2L3MBTL1PTPN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010066357-A1 | BENZOTHIAZOLE AMIDES FOR DETECTION OF AMYLOID BETA | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-06-17 | — | — | WO | disclosed |
| EP-0697387-B1 | Improved method for the preparation of iodonium salts | DOW CORNING (US) | 1998-04-22 | — | — | EP | disclosed |