Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.46 |
| ▸ | BAD | Q92934 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MMP3 | P08254 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7938359 | 0.91 | ALDH1A1 (0.60) | ALDH1A1CYP1A2BCL2L1BADALOX5 | |
| SCHEMBL12444110 | 0.91 | ALDH1A1 (0.60) | ALDH1A1CYP1A2BCL2L1BADALOX5 | |
| SCHEMBL412237 | 0.91 | ALDH1A1 (0.60) | ALDH1A1CYP1A2BCL2L1BADALOX5 | |
| SCHEMBL11491288 | 0.88 | ALDH1A1 (0.56) | ALDH1A1CYP1A2BCL2L1BADALOX5 | |
| Water SCHEMBL6337149 | 0.88 | ALDH1A1 (0.56) | ALDH1A1CYP1A2BCL2L1BADALOX5 | |
| Water SCHEMBL3745867 | 0.88 | ALDH1A1 (0.56) | ALDH1A1CYP1A2BCL2L1BADALOX5 | |
| SCHEMBL29130498 | 0.88 | ALDH1A1 (0.56) | ALDH1A1CYP1A2BCL2L1BADALOX5 | |
| Hydrochloric Acid SCHEMBL28569432 | 0.86 | ALDH1A1 (0.53) | ALDH1A1CYP1A2BCL2L1BADALOX5 | |
| SCHEMBL28421428 | 0.86 | ALDH1A1 (0.53) | ALDH1A1CYP1A2BCL2L1BADALOX5 | |
| SCHEMBL28348758 | 0.83 | BCL2L1 (0.52) | ALDH1A1CYP1A2BCL2L1BADMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112916046-B | Three-way catalyst system and application thereof in ethylene oligomerization reaction | 万华化学集团股份有限公司 | 2022-04-19 | — | — | CN | disclosed |
| CN-112916046-A | Three-way catalyst system and application thereof in ethylene oligomerization reaction | 万华化学集团股份有限公司 | 2021-06-08 | — | — | CN | disclosed |