Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.40 |
| ▸ | WNT3A | P56704 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13187727 | 0.89 | CYP19A1 (0.49) | MEN1RAB9AKMT2AADORA3ADORA1 | |
| SCHEMBL3710322 | 0.88 | FNTA (0.39) | HDAC6MEN1RAB9AKMT2AADORA3 | |
| SCHEMBL13188515 | 0.84 | HDAC6 (0.45) | HDAC6SMPD1ADORA3ADORA1ADORA2A | |
| SCHEMBL13187833 | 0.84 | ADORA3 (0.53) | HDAC6SMPD1RAB9AADORA3ADORA1 | |
| SCHEMBL13188617 | 0.82 | HDAC6 (0.50) | HDAC6SMPD1HDAC1MKNK1MKNK2 | |
| SCHEMBL13188377 | 0.82 | WNT3A (0.49) | HDAC6SMPD1MEN1RAB9AKMT2A | |
| SCHEMBL13188800 | 0.81 | HDAC1 (0.55) | HDAC6SMPD1ADORA3ADORA1HDAC1 | |
| SCHEMBL13188356 | 0.81 | ABL1 (0.52) | — | |
| SCHEMBL13188289 | 0.81 | CYP1A2 (0.55) | HDAC6SMPD1RAB9AADORA1HDAC1 | |
| SCHEMBL13188797 | 0.81 | ADORA1 (0.53) | HDAC6SMPD1ADORA3ADORA1ADORA2A |
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 |