Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 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 | |
|---|---|---|---|---|
| SCHEMBL1011491 | 0.69 | CREBBP (0.39) | MEN1KMT2ABRD4CREBBPNPC1 | |
| SCHEMBL10064030 | 0.69 | ALDH1A1 (0.33) | ALDH1A1TSHRIDO1 | |
| SCHEMBL24541282 | 0.67 | BCHE (0.31) | BCHEACHE | |
| SCHEMBL20982375 | 0.67 | BCHE (0.31) | BCHEACHE | |
| SCHEMBL7612604 | 0.66 | BRD4 (0.40) | ALDH1A1BRD4CREBBPGAAHPGD | |
| SCHEMBL4937238 | 0.61 | MEN1 (0.40) | MEN1KMT2AGAAMAPK1TDP1 | |
| SCHEMBL18890497 | 0.61 | MEN1 (0.40) | MEN1KMT2AGAAMAPK1TDP1 | |
| SCHEMBL7581735 | 0.61 | MEN1 (0.40) | MEN1KMT2AGAAMAPK1TDP1 | |
| SCHEMBL11069336 | 0.61 | BRD4 (0.66) | ALDH1A1HSD17B10SMN1; SMN2TSHRMEN1 | |
| SCHEMBL9024189 | 0.61 | HSD17B10 (0.53) | ALDH1A1HSD17B10SMN1; SMN2TSHRMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023124728-A1 | METHOD AND SYSTEM FOR PREPARING DIPHENYLAMINE AND PHENOTHIAZINE FROM ANILINE | 中国石油化工股份有限公司 | 2023-07-06 | — | — | WO | disclosed |