Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | ADH1B | P00325 | 1/20 | 0.31 |
| ▸ | ADH1C | P00326 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 1/20 | 0.31 |
| ▸ | ADH4 | P08319 | 1/20 | 0.31 |
| ▸ | ADH7 | P40394 | 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 | |
|---|---|---|---|---|
| SCHEMBL8156464 | 0.87 | ALDH1A1 (0.55) | ALDH1A1CYP3A4EPHX1HIF1A | |
| SCHEMBL268784 | 0.86 | ALDH1A1 (0.42) | ALDH1A1EPHX1ADH1BADH1CADH1A | |
| SCHEMBL2891590 | 0.84 | — | — | |
| SCHEMBL1578456 | 0.81 | ALDH1A1 (0.47) | ALDH1A1CYP3A4 | |
| SCHEMBL48238 | 0.80 | ALDH1A1 (0.38) | ALDH1A1ADH1BADH1CADH1AADH4 | |
| SCHEMBL21239945 | 0.80 | ALDH1A1 (0.38) | ALDH1A1ADH1BADH1CADH1AADH4 | |
| SCHEMBL9160524 | 0.80 | ALDH1A1 (0.48) | ALDH1A1CYP3A4 | |
| SCHEMBL3692469 | 0.80 | — | — | |
| SCHEMBL19215804 | 0.77 | ALDH1A1 (0.40) | ALDH1A1CYP3A4 | |
| SCHEMBL560016 | 0.76 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008070139-A1 | ABRASION RESISTANT TWO-COMPONENT WATERBORNE POLYURETHANE COATINGS | RHODIA INC. (US) | 2008-06-12 | — | — | WO | claimed |
| US-20080139775-A1 | Abrasion resistant two-component waterborne polyurethane coatings | PERSTORP FRANCE (FR) | 2008-06-12 | — | — | US | claimed |
| WO-2008042325-A1 | IMPROVED WATER DISPERSIBLE POLYISOCYANATES | RHODIA INC. (US) | 2008-04-10 | — | — | WO | claimed |
| US-20080081871-A1 | Water dispersible polyisocyanates | RHODIA INC. | 2008-04-03 | — | — | US | claimed |