Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.46 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3601801 | 0.89 | TDP1 (0.55) | TDP1ALDH1A1NCOA1NCOA3POLB | |
| SCHEMBL57166 | 0.82 | TDP1 (1.00) | TDP1ALDH1A1NCOA1NCOA3GAA | |
| SCHEMBL29475175 | 0.82 | TDP1 (1.00) | TDP1ALDH1A1NCOA1NCOA3GAA | |
| SCHEMBL11891523 | 0.81 | TDP1 (0.67) | TDP1ALDH1A1NCOA1NCOA3GAA | |
| SCHEMBL11818394 | 0.81 | TDP1 (0.55) | TDP1ALDH1A1NCOA1NCOA3GAA | |
| SCHEMBL30627320 | 0.80 | ALDH1A1 (0.50) | TDP1ALDH1A1POLBGPR35SMN1; SMN2 | |
| SCHEMBL1999849 | 0.80 | ALDH1A1 (0.50) | TDP1ALDH1A1POLBGPR35SMN1; SMN2 | |
| SCHEMBL28093598 | 0.80 | TDP1 (0.95) | TDP1ALDH1A1NCOA1NCOA3GAA | |
| SCHEMBL1995565 | 0.79 | TDP1 (0.47) | TDP1ALDH1A1GPR35PARP1SMN1; SMN2 | |
| SCHEMBL6515 | 0.79 | TDP1 (0.47) | TDP1ALDH1A1GPR35PARP1SMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0511152-A2 | Quinoxaline compounds, their preparation and use | NOVO NORDISK A/S (DK) | 1992-10-28 | — | — | EP | disclosed |
| EP-0023584-B1 | PROCESS FOR THE PREPARATION OF TRIFLUOROMETHYL NAPHTHALENES | BAYER AG (DE) | 1983-01-26 | — | — | EP | disclosed |
| US-4331613-A | Process for the preparation of trifluoromethylnaphthalenes | BAYER AKTIENGESELLSCHAFT (DE) | 1982-05-25 | — | — | US | disclosed |
| EP-0023584-A1 | Process for the preparation of trifluoromethyl naphthalenes | BAYER AG (DE) | 1981-02-11 | — | — | EP | disclosed |