Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 2/20 | 0.56 |
| ▸ | TLR1 | Q15399 | 2/20 | 0.56 |
| ▸ | TLR6 | Q9Y2C9 | 2/20 | 0.56 |
| ▸ | ERN1 | O75460 | 1/20 | 0.56 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.50 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.50 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.49 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29954715 | 0.83 | ABCG2 (0.64) | ABCG2NPC1HTTSMN1; SMN2AR | |
| SCHEMBL1697561 | 0.83 | ABCG2 (0.64) | ABCG2NPC1HTTSMN1; SMN2AR | |
| SCHEMBL6635025 | 0.82 | NPC1 (0.50) | KDM4EMAPTMAPK1HSD17B10ALDH1A1 | |
| Water SCHEMBL3048073 | 0.81 | ABCG2 (0.62) | ABCG2NPC1HTTSMN1; SMN2AR | |
| SCHEMBL480276 | 0.81 | KDM4E (0.59) | TLR2TLR1TLR6ERN1NR1H4 | |
| SCHEMBL30463054 | 0.81 | KDM4E (0.59) | TLR2TLR1TLR6ERN1NR1H4 | |
| SCHEMBL29360359 | 0.79 | MAPT (0.59) | TLR2TLR1TLR6ERN1KDM4E | |
| SCHEMBL2066210 | 0.79 | KDM4E (0.57) | TLR2TLR1TLR6ERN1NR1H4 | |
| SCHEMBL22588880 | 0.79 | KDM4E (0.57) | TLR2TLR1TLR6ERN1NR1H4 | |
| SCHEMBL29502905 | 0.79 | LMNA (0.57) | TLR2TLR1TLR6ERN1KDM4E |
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-6184421-B1 | SELECTIVE OXIDATION, TO A CARBOXY GROUP, OF THE GROUP IN THE 2 POSITION WITH RESPECT TO THE HYDROXYL GROUPS OF A MIXTURE OF PHENOLS HAVING FORMYL AND/OR HYDROXYMETHYL GROUPS IN POSITIONS 2 OR 4; PREPARING VANILLIN AND ETHYL VANILLIN | RHODIA CHIMIE (FR) | 2001-02-06 | — | — | US | disclosed |