Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.48 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.48 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.48 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | STAT1 | P42224 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14919176 | 0.89 | PDK1 (0.45) | HDAC1HDAC8HDAC6PDK1PDK2 | |
| SCHEMBL14918928 | 0.88 | HDAC4 (0.45) | HDAC1HDAC8HDAC6SMN1; SMN2NPC1 | |
| SCHEMBL14918432 | 0.88 | HDAC8 (0.45) | HDAC1HDAC8HDAC6MAPTSMN1; SMN2 | |
| SCHEMBL14918887 | 0.86 | MAPT (0.53) | HDAC1HDAC8HDAC6MAPTSMN1; SMN2 | |
| SCHEMBL14918364 | 0.85 | HDAC6 (0.52) | HDAC1HDAC8HDAC6PDK1PDK2 | |
| SCHEMBL14918935 | 0.85 | MAPT (0.52) | HDAC1HDAC8HDAC6MAPTSMN1; SMN2 | |
| SCHEMBL14918725 | 0.85 | MAPT (0.52) | HDAC1HDAC8HDAC6MAPTSMN1; SMN2 | |
| SCHEMBL14918847 | 0.85 | MAPT (0.52) | HDAC1HDAC8HDAC6MAPTSMN1; SMN2 | |
| SCHEMBL14918382 | 0.85 | MAPT (0.54) | HDAC1HDAC8HDAC6MAPTSMN1; SMN2 | |
| SCHEMBL14918896 | 0.83 | MEN1 (0.41) | HDAC1HDAC8HDAC6MAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013066836-A1 | COMPOUNDS AND METHODS | GLAXOSMITHKLINE LLC (US) | 2013-05-10 | — | — | WO | claimed |