Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.65 |
| ▸ | ALOX12 | P18054 | 5/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.65 |
| ▸ | TSHR | P16473 | 4/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.65 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.65 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.65 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.65 |
| ▸ | HTR2B | P41595 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 7/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.52 |
| ▸ | HPGD | P15428 | 5/20 | 0.52 |
| ▸ | HTT | P42858 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 5/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL21989958 | 1.00 | ALDH1A1 (0.65) | ALDH1A1HSD17B10ALOX12L3MBTL1TSHR | |
| SCHEMBL14019644 | 0.87 | MAPT (0.75) | ALDH1A1HSD17B10ALOX12L3MBTL1TSHR | |
| SCHEMBL14019645 | 0.85 | ALDH1A1 (0.52) | ALDH1A1HSD17B10ALOX12L3MBTL1TSHR | |
| SCHEMBL22258954 | 0.83 | ALDH1A1 (0.50) | ALDH1A1HSD17B10ALOX12L3MBTL1TSHR | |
| Diphenylamine SCHEMBL29287150 | 0.83 | ALDH1A1 (0.62) | ALDH1A1HSD17B10ALOX12L3MBTL1TSHR | |
| SCHEMBL502030 | 0.83 | ALDH1A1 (0.62) | ALDH1A1HSD17B10ALOX12L3MBTL1TSHR | |
| SCHEMBL1576428 | 0.81 | ALDH1A1 (0.59) | ALDH1A1HSD17B10ALOX12L3MBTL1TSHR | |
| SCHEMBL7896372 | 0.81 | ALDH1A1 (1.00) | ALDH1A1HSD17B10ALOX12L3MBTL1TSHR | |
| SCHEMBL9846771 | 0.81 | KCNN4 (0.50) | ALDH1A1TSHRALOX15MAPK1CYP3A4 | |
| SCHEMBL9480038 | 0.81 | ALDH1A1 (1.00) | ALDH1A1HSD17B10ALOX12L3MBTL1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001056091-A2 | CHARGE TRANSPORT MATERIAL HAVING AN INCREASED GLASS TRANSITION TEMPERATURE AND THE USE OF SAID MATERIAL | SIEMENS AKTIENGESELLSCHAFT (DE) | 2001-08-02 | — | — | WO | disclosed |
| US-3944492-A | Lubricant compositions containing N-substituted naphthylamines as antioxidants | UNIROYAL, INC. (US) | 1976-03-16 | — | — | US | disclosed |