Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 9/20 | 0.65 |
| ▸ | RAB9A | P51151 | 5/20 | 0.59 |
| ▸ | NPC1 | O15118 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 9/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.56 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 9/20 | 0.55 |
| ▸ | NCOR2 | Q9Y618 | 4/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.51 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.51 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.51 |
| ▸ | ESRRG | P62508 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL2654333 | 0.90 | HDAC3 (0.58) | HDAC3RAB9ANPC1HDAC2HDAC8 | |
| SCHEMBL9109405 | 0.89 | HDAC3 (0.80) | HDAC3RAB9ANPC1HDAC2HDAC8 | |
| SCHEMBL9109090 | 0.89 | HDAC3 (0.74) | HDAC3RAB9ANPC1HDAC2HDAC8 | |
| SCHEMBL2995407 | 0.89 | RAB9A (0.72) | HDAC3RAB9ANPC1ALDH1A1HDAC2 | |
| SCHEMBL17141809 | 0.89 | HDAC3 (0.83) | HDAC3RAB9ANPC1HDAC2HDAC8 | |
| SCHEMBL9109950 | 0.85 | HDAC3 (0.52) | HDAC3RAB9ANPC1HDAC2HDAC8 | |
| SCHEMBL9110617 | 0.85 | HDAC3 (0.59) | HDAC3RAB9ANPC1ALDH1A1HDAC2 | |
| SCHEMBL9110816 | 0.85 | HDAC3 (0.63) | HDAC3RAB9ANPC1ALDH1A1HDAC2 | |
| SCHEMBL17833172 | 0.85 | KMT2A (0.74) | HDAC3RAB9ANPC1HDAC2HDAC1 | |
| SCHEMBL9108525 | 0.85 | ALDH1A1 (0.64) | HDAC3RAB9ANPC1ALDH1A1HDAC2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0631571-A1 | PREPARATION OF OPTICALLY ACTIVE HYDRAZINES AND AMINES. | DU PONT (US) | 1995-01-04 | — | — | EP | claimed |
| CN-107880075-A | Rhodium catalyst and the method for preparing amines | 武田药品工业株式会社 | 2018-04-06 | — | — | CN | disclosed |
| CN-104321330-B | Rhodium catalyst and process for producing amine compound | 武田药品工业株式会社 | 2017-12-08 | — | — | CN | disclosed |
| EP-0631571-A1 | PREPARATION OF OPTICALLY ACTIVE HYDRAZINES AND AMINES. | DU PONT (US) | 1995-01-04 | — | — | EP | disclosed |