Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.43 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL20022001 | 0.82 | CYP1A2 (0.61) | HRH3CYP2A6BCHEHDAC3HDAC1 | |
| SCHEMBL23070463 | 0.82 | GRIN2D (0.47) | HRH3BCHEAOC3CYP1A2 | |
| SCHEMBL29808986 | 0.82 | GRIN2D (0.47) | HRH3BCHEAOC3CYP1A2 | |
| SCHEMBL4371629 | 0.81 | HRH3 (0.67) | HRH3HDAC8HDAC6AOC3 | |
| SCHEMBL24503176 | 0.81 | HDAC1 (0.45) | HRH3BCHEHDAC3HDAC4HDAC1 | |
| SCHEMBL14562409 | 0.81 | CYP2A6 (0.50) | HRH3CYP2A6BCHEHDAC3HDAC4 | |
| SCHEMBL7315600 | 0.81 | HRH3 (0.50) | HRH3BCHEHDAC3HDAC4HDAC1 | |
| SCHEMBL14562408 | 0.79 | HRH3 (0.48) | HRH3CYP2A6BCHEHDAC3HDAC4 | |
| Hydrochloric Acid SCHEMBL27898665 | 0.79 | HRH3 (0.48) | HRH3CYP2A6BCHEHDAC3HDAC4 | |
| SCHEMBL9016348 | 0.78 | ASIC3 (0.57) | HRH3CYP2A6ASIC3CA12CA1 |
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-0901465-B1 | COMPOUNDS WITH ANTI-INFLAMMATORY AND IMMUNOSUPPRESSIVE ACTIVITIES | ITALFARMACO SPA (IT) | 2000-09-27 | — | — | EP | disclosed |
| US-6034096-A | Compounds with anti-inflammatory and immunosuppressive activities | ITALFARMACO S.P.A. (IT) | 2000-03-07 | — | — | US | disclosed |
| EP-0901465-A1 | COMPOUNDS WITH ANTI-INFLAMMATORY AND IMMUNOSUPPRESSIVE ACTIVITIES | ITALFARMACO S.p.A. (IT) | 1999-03-17 | — | — | EP | disclosed |
| WO-1997043251-A1 | COMPOUNDS WITH ANTI-INFLAMMATORY AND IMMUNOSUPPRESSIVE ACTIVITIES | ITALFARMACO S.P.A. (IT) | 1997-11-20 | — | — | WO | disclosed |