Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | F10 | P00742 | 6/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5221896 | 0.70 | HIF1A (0.41) | HIF1ACYP3A4CYP2C9CYP2D6HRH3 | |
| SCHEMBL5759922 | 0.69 | MAPT (0.62) | HIF1ACYP3A4ALDH1A1CYP2C9CYP2D6 | |
| SCHEMBL31519913 | 0.68 | ALDH1A1 (0.46) | ALDH1A1TSHRKDM4EHPGD | |
| SCHEMBL5222775 | 0.68 | MEN1 (0.47) | CYP3A4CYP2C19CYP2C9F10ITGB3 | |
| SCHEMBL5224718 | 0.67 | HDAC3 (0.42) | F10ITGB3ITGA2BHTR4 | |
| SCHEMBL5227299 | 0.67 | HIF1A (0.50) | HIF1ACYP3A4ALDH1A1CYP2C19CYP2C9 | |
| Hydrochloric Acid SCHEMBL5225043 | 0.67 | HDAC3 (0.41) | F10ITGB3ITGA2BHTR4 | |
| SCHEMBL5227295 | 0.66 | HIF1A (0.49) | HIF1ACYP3A4ALDH1A1CYP2C19CYP2C9 | |
| SCHEMBL31150607 | 0.66 | FAAH (0.41) | ALDH1A1TSHRKDM4ENPC1MAPT | |
| SCHEMBL12426327 | 0.66 | F10 (0.49) | ALDH1A1F10HTR4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1019045-A4 | ANTITHROMBOTIC AGENTS | LILLY CO ELI (US) | 2002-07-03 | — | — | EP | disclosed |
| EP-1019045-A1 | ANTITHROMBOTIC AGENTS | ELI LILLY AND COMPANY (US) | 2000-07-19 | — | — | EP | disclosed |
| WO-1999000128-A9 | ANTITHROMBOTIC AGENTS | LILLY CO ELI (US) | 1999-08-05 | — | — | WO | disclosed |
| WO-1999000128-A1 | ANTITHROMBOTIC AGENTS | ELI LILLY AND COMPANY (US) | 1999-01-07 | — | — | WO | disclosed |