Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 10/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | HPGDS | O60760 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19976449 | 0.79 | HDAC4 (0.48) | MLYCDHDAC4HDAC6HDAC1HDAC3 | |
| SCHEMBL16964549 | 0.79 | NPC1 (0.47) | MLYCDHDAC4HDAC6HDAC1HDAC3 | |
| SCHEMBL16964206 | 0.78 | KDM4E (0.43) | MLYCDHDAC4HDAC6HDAC1HDAC3 | |
| SCHEMBL19976499 | 0.75 | MLYCD (0.46) | MLYCDHDAC4HDAC6HDAC1HDAC3 | |
| SCHEMBL19976443 | 0.75 | HDAC4 (0.44) | MLYCDHDAC4HDAC6HDAC1HDAC3 | |
| SCHEMBL16991011 | 0.74 | KDM4E (0.43) | MLYCDHDAC4HDAC6HDAC1HDAC3 | |
| SCHEMBL16964243 | 0.74 | KDM4E (0.54) | MLYCDKDM4EALDH1A1 | |
| SCHEMBL6513323 | 0.74 | PLOD2 (0.54) | HDAC4 | |
| SCHEMBL16964231 | 0.74 | MLYCD (0.55) | MLYCDHDAC3ALDH1A1 | |
| SCHEMBL16963678 | 0.73 | KDM4E (0.73) | KDM4EALDH1A1 |
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 |