Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.67 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.61 |
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | RAB9A | P51151 | 3/20 | 0.61 |
| ▸ | MAOA | P21397 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.61 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | MIF | P14174 | 3/20 | 0.53 |
| ▸ | METAP1 | P53582 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | CYP26A1 | O43174 | 3/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL7517262 | 0.89 | MIF (0.66) | CYP19A1ALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL29127815 | 0.87 | CYP19A1 (0.60) | MAOBCYP19A1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL6361474 | 0.85 | MAOB (0.67) | MAOBCYP19A1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL6361472 | 0.85 | MAOB (0.67) | MAOBCYP19A1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL3502646 | 0.82 | MAOB (0.85) | MAOBCYP19A1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL6990658 | 0.82 | MAOB (0.64) | MAOBCYP19A1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL17571252 | 0.82 | MAOB (0.64) | MAOBCYP19A1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL6990660 | 0.82 | MAOB (0.64) | MAOBCYP19A1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL13254636 | 0.82 | MAOB (0.85) | MAOBCYP19A1ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL30832103 | 0.79 | MAOB (0.79) | MAOBCYP19A1ALDH1A1SMN1; SMN2NPC1 |
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-0856001-B1 | PYRIMIDINE DERIVATIVES AS 5HT2C RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2002-08-28 | — | — | EP | disclosed |
| EP-0856001-A1 | PYRIMIDINE DERIVATIVES AS 5HT 2C?-RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 1998-08-05 | — | — | EP | disclosed |
| US-5753663-A | 5HT2C ANTAGONIST, USEFUL FOR TREATING ANXIETY, PAIN, OBSESSIVE COMPULSIVE DISORDER, ALCOHOLISM, DEPRESSION, MIGRAINE, SLEEP DISORDER, ANOREXIA NERVOSA AND PRIAPISM | SYNTEX (U.S.A.) INC. (US) | 1998-05-19 | — | — | US | disclosed |
| WO-1997012880-A1 | PYRIMIDINE DERIVATIVES AS 5HT2C-RECEPTOR ANTAGONISTS | F.HOFFMANN-LA ROCHE AG (CH) | 1997-04-10 | — | — | WO | disclosed |