Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.35 |
| ▸ | GABBR2 | O75899 | 2/20 | 0.33 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.33 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.32 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.32 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.32 |
| ▸ | ANPEP | P15144 | 1/20 | 0.32 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.32 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | THPO | P40225 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18086894 | 1.00 | ALDH1A1 (0.35) | ALDH1A1GABRR1GABBR2GABBR1SLC1A3 | |
| SCHEMBL7610543 | 0.87 | TSHR (0.39) | ALDH1A1SLC1A3SLC1A2SLC1A1ANPEP | |
| SCHEMBL2233938 | 0.84 | GABRR1 (0.30) | GABRR1 | |
| SCHEMBL10937040 | 0.84 | GABRR1 (0.30) | GABRR1 | |
| SCHEMBL4006368 | 0.81 | TRPV1 (0.42) | ALDH1A1TRPV1TRPA1 | |
| SCHEMBL289810 | 0.80 | — | — | |
| SCHEMBL20833191 | 0.79 | — | — | |
| SCHEMBL20758116 | 0.79 | — | — | |
| SCHEMBL1752089 | 0.79 | — | — | |
| SCHEMBL7429318 | 0.79 | ALDH1A1 (0.40) | ALDH1A1GABBR2GABBR1SLC1A3SLC1A2 |
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-107074734-A | Process for making N-alkyl polyamines | 库扎环球有限责任公司 | 2017-08-18 | — | — | CN | disclosed |
| WO-2015142689-A1 | SLIP RESISTANT ARTICLE AND THE METHOD FOR PREPARING THE SAME | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2015-09-24 | — | — | WO | disclosed |