Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.54 |
| ▸ | METAP1 | P53582 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.42 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.42 |
| ▸ | CYP27A1 | Q02318 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7519184 | 0.88 | CYP24A1 (0.54) | CYP19A1METAP1DRD2CYP24A1CYP26A1 | |
| SCHEMBL5237012 | 0.81 | ACHE (0.71) | ACHECYP19A1METAP1MAOBDRD2 | |
| SCHEMBL5237018 | 0.81 | ACHE (0.71) | ACHECYP19A1METAP1MAOBDRD2 | |
| SCHEMBL5237022 | 0.81 | ACHE (0.71) | ACHECYP19A1METAP1MAOBDRD2 | |
| SCHEMBL8599809 | 0.80 | CYP19A1 (0.62) | ACHECYP19A1METAP1CYP24A1CYP26A1 | |
| SCHEMBL3875408 | 0.80 | ACHE (0.56) | ACHECYP19A1METAP1MAOBDRD2 | |
| SCHEMBL992002 | 0.80 | ACHE (0.56) | ACHECYP19A1METAP1MAOBDRD2 | |
| SCHEMBL13363970 | 0.80 | ACHE (0.56) | ACHECYP19A1METAP1MAOBDRD2 | |
| SCHEMBL6630846 | 0.80 | ACHE (0.56) | ACHECYP19A1METAP1MAOBDRD2 | |
| SCHEMBL31040171 | 0.80 | CYP19A1 (0.59) | ACHECYP19A1METAP1MAOBDRD2 |
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 2 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 |
| 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 |