Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.32 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.32 |
| ▸ | CAD | P27708 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | METAP1 | P53582 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9743811 | 1.00 | CYP2D6 (0.44) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL10755241 | 0.84 | CYP2D6 (0.46) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL9745890 | 0.82 | ATM (0.43) | CYP2C9CYP2C19ALDH1A1LMNAHCAR2 | |
| SCHEMBL9745874 | 0.82 | ATM (0.43) | CYP2C9CYP2C19ALDH1A1LMNAHCAR2 | |
| SCHEMBL9468653 | 0.78 | CYP2D6 (0.47) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL9468728 | 0.78 | CYP2D6 (0.47) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL9744820 | 0.77 | CYP2D6 (0.55) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL9744815 | 0.77 | CYP2D6 (0.55) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL22329028 | 0.76 | CYP2D6 (0.46) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 | |
| SCHEMBL29253119 | 0.73 | CYP2D6 (0.44) | CYP2D6CYP2C9CYP2C19ALOX15ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5175344-A | Anticonvulsants, anxiolytic agents | CIBA-GEIGY CORPORATION (US) | 1992-12-29 | — | — | US | disclosed |
| EP-0233154-B1 | UNSATURATED AMINO-ACIDS | CIBA-GEIGY AG (CH) | 1991-12-18 | — | — | EP | disclosed |
| US-5051413-A | For treatment of ischemia, antispasmodic agents, anticonvulsants and anxiety or manic conditions | CIBA-GEIGY CORPORATION (US) | 1991-09-24 | — | — | US | disclosed |
| EP-0302826-A2 | Process for the preparation of unsaturated amino acid compounds | CIBA-GEIGY AG (CH) | 1989-02-08 | — | — | EP | disclosed |