Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.33 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL234712 | 0.91 | ALDH1A1 (0.39) | ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20 | |
| SCHEMBL27674635 | 0.90 | TDP1 (0.35) | ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20 | |
| Acrylic Acid SCHEMBL1123835 | 0.89 | ALDH1A1 (0.40) | ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20 | |
| Ammonia Solution, Strong SCHEMBL28169209 | 0.89 | ALDH1A1 (0.38) | ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20 | |
| SCHEMBL6419402 | 0.89 | ALDH1A1 (0.38) | ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20 | |
| Acrylic Acid SCHEMBL27348963 | 0.83 | ALDH1A1 (0.35) | ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20 | |
| SCHEMBL9658496 | 0.79 | TSHR (0.55) | ALDH1A1CYP3A4ZDHHC20ZDHHC2TSHR | |
| Acrylic Acid SCHEMBL27647713 | 0.78 | ALDH1A1 (0.32) | ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20 | |
| SCHEMBL29192529 | 0.78 | ZDHHC20 (0.40) | ALDH1A1CYP3A4CYP2C9CYP2C19ZDHHC20 | |
| Diethylaminoethanol SCHEMBL11691979 | 0.77 | ALDH1A1 (0.32) | ALDH1A1CYP3A4CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5856370-A | NITROGEN DISPERSED IN THE POLYMER AND AT LEAST ONE AZO COMPOUND AS INITIATOR AND BLOWING AGENT | STOCKHAUSEN GMBH & CO. KG (DE) | 1999-01-05 | — | — | US | claimed |