Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.64 |
| ▸ | MEN1 | O00255 | 4/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2948761 | 0.79 | CYP2D6 (1.00) | CYP2D6KMT2AMEN1CYP2C9CYP2C19 | |
| SCHEMBL2951196 | 0.79 | CYP2D6 (1.00) | CYP2D6KMT2AMEN1CYP2C9CYP2C19 | |
| SCHEMBL29930592 | 0.79 | CYP2D6 (1.00) | CYP2D6KMT2AMEN1CYP2C9CYP2C19 | |
| SCHEMBL2947846 | 0.79 | CYP2D6 (1.00) | CYP2D6KMT2AMEN1CYP2C9CYP2C19 | |
| SCHEMBL2948760 | 0.79 | CYP2D6 (1.00) | CYP2D6KMT2AMEN1CYP2C9CYP2C19 | |
| SCHEMBL2948561 | 0.79 | CYP2D6 (1.00) | CYP2D6KMT2AMEN1CYP2C9CYP2C19 | |
| SCHEMBL2948565 | 0.79 | CYP2D6 (1.00) | CYP2D6KMT2AMEN1CYP2C9CYP2C19 | |
| SCHEMBL2951193 | 0.79 | CYP2D6 (1.00) | CYP2D6KMT2AMEN1CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL30529824 | 0.78 | CYP2D6 (0.98) | CYP2D6KMT2AMEN1CYP2C9CYP2C19 | |
| SCHEMBL8976279 | 0.77 | CYP2D6 (0.70) | CYP2D6KMT2AMEN1CYP2C9CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5500418-A | ANTIEPILEPTIC | CIBA-GEIGY CORPORATION (US) | 1996-03-19 | — | — | US | disclosed |