Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 6/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | XBP1 | P17861 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HSPA5 | P11021 | 2/20 | 0.34 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.34 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6650376 | 0.87 | HSPA5 (0.50) | CYP2C19CYP2D6CYP2C9CYP1A2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6649318 | 0.85 | HSPA5 (0.48) | CYP2C19CYP2D6CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL6649041 | 0.84 | HSPA5 (0.49) | CYP2C19CYP2D6CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL663756 | 0.81 | CYP2C19 (0.59) | CYP2C19CYP2D6CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL5673666 | 0.81 | CYP2C19 (0.59) | CYP2C19CYP2D6CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL1881392 | 0.81 | CYP2C19 (0.59) | CYP2C19CYP2D6CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL663757 | 0.81 | CYP2C19 (0.59) | CYP2C19CYP2D6CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL8783194 | 0.80 | CYP2C19 (0.58) | CYP2C19CYP2D6CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL6057504 | 0.80 | CYP2C19 (0.78) | CYP2C19CYP2D6CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL30874729 | 0.80 | CYP2C19 (0.58) | CYP2C19CYP2D6CYP2C9CYP1A2ALDH1A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0741731-B1 | PROCESS FOR EPOXIDISING PROCHIRAL OLEFINS | SMITHKLINE BEECHAM PLC (GB) | 2004-04-07 | — | — | EP | disclosed |
| US-6211107-B1 | Process for expoxidizing prochiral olefins and a catalyst therefor and intermediates for making the catalyst | SMITHKLINE BEECHAM P.L.C. (GB) | 2001-04-03 | — | — | US | disclosed |
| US-5616750-A | Compounds and process | SMITHKLINE BEECHAM PLC (GB) | 1997-04-01 | — | — | US | disclosed |
| EP-0741731-A1 | PROCESS FOR EPOXIDISING PROCHIRAL OLEFINS AND A CATALYST THEREFOR AND INTERMEDIATES FOR MAKING THE CATALYST | SMITHKLINE BEECHAM PLC (GB) | 1996-11-13 | — | — | EP | disclosed |
| EP-0655950-B1 | CHIRAL CATALYSTS AND EPOXIDATION REACTIONS CATALYZED THEREBY | SMITHKLINE BEECHAM PLC (GB) | 1996-10-23 | — | — | EP | disclosed |
| WO-1995021172-A1 | PROCESS FOR EPOXIDISING PROCHIRAL OLEFINS AND A CATALYST THEREFOR AND INTERMEDIATES FOR MAKING THE CATALYST | SMITHKLINE BEECHAM P.L.C. (GB) | 1995-08-10 | — | — | WO | disclosed |