Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | DGKA | P23743 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.37 |
| ▸ | P2RY10 | O00398 | 1/20 | 0.36 |
| ▸ | GPR34 | Q9UPC5 | 1/20 | 0.36 |
| ▸ | PAM | P19021 | 2/20 | 0.36 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17718078 | 0.92 | ALDH1A1 (0.43) | ALDH1A1DGKALMNACES2CES1 | |
| SCHEMBL4452697 | 0.88 | ALDH1A1 (0.40) | ALDH1A1DGKALMNAHSD17B10SERPINE1 | |
| SCHEMBL6406466 | 0.86 | DGKA (0.52) | ALDH1A1DGKALMNACES2CES1 | |
| SCHEMBL517466 | 0.86 | ALDH1A1 (0.50) | ALDH1A1DGKALMNACES2CES1 | |
| SCHEMBL3203892 | 0.86 | ALDH1A1 (0.50) | ALDH1A1DGKALMNACES2CES1 | |
| SCHEMBL855142 | 0.85 | DGKA (0.61) | ALDH1A1DGKALMNAP2RY10GPR34 | |
| SCHEMBL9323708 | 0.84 | ALDH1A1 (0.48) | ALDH1A1DGKALMNACES2CES1 | |
| SCHEMBL525482 | 0.83 | ALDH1A1 (0.52) | ALDH1A1DGKALMNACES2CES1 | |
| SCHEMBL33575 | 0.83 | DGKA (0.64) | ALDH1A1DGKALMNAP2RY10GPR34 | |
| SCHEMBL17812465 | 0.83 | DGKA (0.64) | ALDH1A1DGKALMNAP2RY10GPR34 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-9125080-A | — | — | None | — | — | JP | disclosed |
| JP-9125085-A | — | — | None | — | — | JP | disclosed |
| US-10793807-B2 | Organoleptic compounds | INTERNATIONAL FLAVORS & FRAGRANCES INC (US) | 2020-10-06 | — | — | US | disclosed |
| WO-2020018737-A1 | NOVEL ORGANOLEPTIC COMPOUNDS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2020-01-23 | — | — | WO | disclosed |
| JP-H09125080-A | HEAT-RESISTANT LUBRICATING OIL COMPOSITION | TONEN CORP | 1997-05-13 | — | — | JP | disclosed |
| JP-H09125085-A | HEAT-RESISTANT LUBRICATING OIL COMPOSITION | TONEN CORP | 1997-05-13 | — | — | JP | disclosed |