Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.50 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 4/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 4/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | DHODH | Q02127 | 1/20 | 0.45 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.45 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13188001 | 0.91 | LMNA (0.49) | HDAC6SMPD1HDAC1KDR | |
| SCHEMBL13187833 | 0.90 | ADORA3 (0.53) | HDAC6SMPD1HDAC1HDAC3HDAC2 | |
| SCHEMBL13188800 | 0.90 | HDAC1 (0.55) | HDAC6SMPD1HDAC1HDAC3HDAC2 | |
| SCHEMBL13188354 | 0.89 | HDAC6 (0.45) | HDAC6SMPD1HDAC1HDAC3HDAC2 | |
| SCHEMBL13188356 | 0.89 | ABL1 (0.52) | — | |
| SCHEMBL13188289 | 0.87 | CYP1A2 (0.55) | HDAC6SMPD1HDAC1HDAC3HDAC2 | |
| SCHEMBL13187746 | 0.87 | DEGS1 (0.60) | HDAC6SMPD1HDAC1HDAC3HDAC2 | |
| SCHEMBL13188875 | 0.87 | MKNK1 (0.55) | HDAC6SMPD1HDAC1HDAC3HDAC2 | |
| SCHEMBL13188797 | 0.87 | ADORA1 (0.53) | HDAC6SMPD1HDAC1HDAC3HDAC2 | |
| SCHEMBL13188371 | 0.86 | BRAF (0.47) | HDAC6SMPD1MKNK1MKNK2ABCB1 |
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-2010100475-A1 | HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2010-09-10 | — | — | WO | disclosed |