Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | AKT1 | P31749 | 1/20 | 0.41 |
| ▸ | CNKSR1 | Q969H4 | 1/20 | 0.41 |
| ▸ | PHGDH | O43175 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.39 |
| ▸ | SGK1 | O00141 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19976433 | 0.90 | ALDH1A1 (0.41) | ALDH1A1PHGDHRAB9AL3MBTL1MAPT | |
| SCHEMBL16964699 | 0.87 | PHGDH (0.42) | ALDH1A1PHGDHRAB9AL3MBTL1MAPT | |
| SCHEMBL16964038 | 0.87 | PHGDH (0.44) | ALDH1A1PHGDHRAB9AL3MBTL1MAPT | |
| SCHEMBL16991037 | 0.86 | PHGDH (0.46) | ALDH1A1PHGDHRAB9AL3MBTL1MAPT | |
| SCHEMBL18359009 | 0.85 | POLB (0.47) | ALDH1A1AKT1CNKSR1PHGDHRAB9A | |
| SCHEMBL16991026 | 0.83 | PHGDH (0.41) | ALDH1A1PHGDHRAB9AL3MBTL1SGK1 | |
| SCHEMBL19976448 | 0.82 | ADRB3 (0.42) | PHGDHMAPTSREBF2HDAC3HDAC4 | |
| SCHEMBL17000510 | 0.82 | PHGDH (0.40) | ALDH1A1PHGDHRAB9AL3MBTL1MAPT | |
| SCHEMBL16991041 | 0.81 | HDAC3 (0.44) | ALDH1A1PHGDHMAPTHDAC3HDAC4 | |
| SCHEMBL16963677 | 0.80 | CDK5 (0.41) | ALDH1A1PHGDHRAB9AL3MBTL1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2900638-B1 | COMPOUNDS FOR USE IN THE TREATMENT OF MYCOBACTERIAL INFECTIONS | UNIVERSITÉ DE DROIT ET DE LA SANTÉ DE LILLE 2 (FR) | 2017-01-04 | — | — | EP | disclosed |