Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9010830 | 0.89 | HDAC1 (0.51) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL31268672 | 0.78 | HDAC1 (0.62) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL2732281 | 0.78 | HDAC1 (0.62) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL8400113 | 0.77 | SLC6A2 (0.48) | SMN1; SMN2NPC1MEN1KMT2ACYP2C19 | |
| SCHEMBL3963196 | 0.76 | HDAC1 (0.56) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL1234255 | 0.75 | HDAC1 (0.59) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL20906843 | 0.75 | HDAC1 (0.59) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL9010823 | 0.73 | CYP3A4 (0.43) | KMT2ACYP3A4MAPTALDH1A1 | |
| SCHEMBL4869573 | 0.73 | HDAC1 (0.61) | HDAC1HDAC6LMNATHRBHIF1A | |
| SCHEMBL8403929 | 0.73 | GRN (0.44) | RAB9AMEN1KMT2A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5547984-A | FUNGICIDES | ROHM AND HAAS COMPANY (US) | 1996-08-20 | — | — | US | disclosed |
| US-5529978-A | FUNGICIDE | ROHM AND HAAS COMPANY (US) | 1996-06-25 | — | — | US | disclosed |
| US-5344978-A | Fungicides | ROHM AND HAAS COMPANY (US) | 1994-09-06 | — | — | US | disclosed |
| US-5196046-A | N-acetonyl-substituted-amides | ROHM AND HAAS COMPANY (US) | 1993-03-23 | — | — | US | disclosed |
| EP-0170498-B1 | N-ACETONYL-SUBSTITUTED-AMIDES, COMPOSITIONS CONTAINING THEM AND THEIR USE IN COMBATING FUNGI | ROHM AND HAAS COMPANY (US) | 1991-09-11 | — | — | EP | disclosed |
| US-4863940-A | N-acetonyl-substituted amides and phytopathogenic fungicidal use thereof | ROHM AND HAAS (US) | 1989-09-05 | — | — | US | disclosed |
| EP-0170498-A2 | N-acetonyl-substituted-amides, compositions containing them and their use in combating fungi | ROHM AND HAAS COMPANY (US) | 1986-02-05 | — | — | EP | disclosed |