Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.47 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.47 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11201388 | 0.85 | MAPK1 (0.62) | CYP3A4MAPK1TDP1TSHRMAPT | |
| SCHEMBL11205360 | 0.83 | CYP3A4 (0.66) | CYP3A4MAPK1TDP1TSHRMAPT | |
| SCHEMBL11643284 | 0.82 | CYP3A4 (0.52) | CYP3A4MAPK1TDP1TSHRMAPT | |
| SCHEMBL10815711 | 0.81 | MAPK1 (0.50) | CYP3A4MAPK1TDP1TSHRMAPT | |
| SCHEMBL11763296 | 0.80 | MAPK1 (0.50) | CYP3A4MAPK1TDP1TSHRMAPT | |
| SCHEMBL11513163 | 0.80 | CYP3A4 (0.53) | CYP3A4MAPK1TDP1TSHRMAPT | |
| SCHEMBL11758457 | 0.80 | CYP3A4 (0.50) | CYP3A4MAPK1TDP1TSHRMAPT | |
| SCHEMBL11201898 | 0.79 | TDP1 (0.76) | CYP3A4MAPK1TDP1TSHRMAPT | |
| SCHEMBL11763305 | 0.79 | CYP3A4 (0.58) | CYP3A4MAPK1TDP1TSHRMAPT | |
| SCHEMBL11758464 | 0.79 | MAPK1 (0.58) | CYP3A4MAPK1TDP1TSHRMAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0479384-B1 | Process for treating dinitroanilines with sulfite to reduce impurities and to reduce the ability to produce nitrosamines | DOWELANCO (US) | 1994-08-17 | — | — | EP | disclosed |
| EP-0479384-A1 | Process for treating dinitroanilines with sulfite to reduce impurities and to reduce the ability to produce nitrosamines | DOWELANCO (US) | 1992-04-08 | — | — | EP | disclosed |
| US-RE31226-E | HERBICIDES | ELI LILLY AND COMPANY (US) | 1983-05-03 | — | — | US | disclosed |
| US-RE31227-E | HERBICIDES | ELI LILLY AND COMPANY (US) | 1983-05-03 | — | — | US | disclosed |
| US-4077795-A | 2,4-DINITROANILINE DERIVATIVES | UNION CARBIDE CORPORATION (US) | 1978-03-07 | — | — | US | disclosed |