Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.50 |
| ▸ | MAOA | P21397 | 3/20 | 0.50 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.47 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.47 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.47 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.47 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL15392583 | 0.98 | MAOB (0.52) | MAOBMAOASOAT1CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL15392584 | 0.98 | MAOB (0.52) | MAOBMAOASOAT1CYP1A2CYP2D6 | |
| SCHEMBL17463566 | 0.92 | EPHX1 (0.52) | MAOBMAOACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9323047 | 0.92 | EPHX1 (0.52) | MAOBMAOACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL468022 | 0.87 | EPHX1 (0.61) | MAOACYP1A2CYP2D6CYP2C19GRIN2D | |
| SCHEMBL272604 | 0.87 | EPHX1 (0.61) | MAOACYP1A2CYP2D6CYP2C19GRIN2D | |
| SCHEMBL3451169 | 0.87 | EPHX1 (0.61) | MAOACYP1A2CYP2D6CYP2C19GRIN2D | |
| SCHEMBL15392808 | 0.87 | SOAT1 (0.50) | MAOBMAOASOAT1CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL28839661 | 0.85 | EPHX1 (0.58) | MAOACYP1A2CYP2D6CYP2C19GRIN2D | |
| SCHEMBL17887234 | 0.83 | ACP3 (0.51) | MAOACYP1A2CYP2D6CYP2C19GRIN2D |
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 |
|---|---|---|---|---|---|---|---|
| US-5326762-A | Heterocyclic substituted amides | SCHERING CORPORATION (US) | 1994-07-05 | — | — | US | disclosed |
| US-5149709-A | Treatment of atherosclerosis | SCHERING CORPORATION (US) | 1992-09-22 | — | — | US | disclosed |