Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 1/20 | 0.56 |
| ▸ | ESR1 | P03372 | 13/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 13/20 | 0.56 |
| ▸ | LTA4H | P09960 | 2/20 | 0.53 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.51 |
| ▸ | F2 | P00734 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7768257 | 0.84 | ESR1 (0.56) | ITGA4ESR1ESR2LTA4HCHEK1 | |
| SCHEMBL6594650 | 0.82 | LTA4H (0.60) | ITGA4LTA4HHRH3 | |
| SCHEMBL7441443 | 0.81 | ESR1 (0.56) | ESR1ESR2LTA4HCHEK1HRH3 | |
| SCHEMBL7773130 | 0.78 | ESR1 (0.55) | ESR1ESR2CHEK1F2 | |
| SCHEMBL7451900 | 0.75 | ESR1 (0.84) | ITGA4ESR1ESR2F2 | |
| SCHEMBL6595152 | 0.74 | LTA4H (0.55) | ESR1ESR2LTA4HHRH3 | |
| SCHEMBL6593929 | 0.74 | ESR1 (0.56) | ESR1ESR2LTA4HHRH3 | |
| SCHEMBL7774143 | 0.74 | LTA4H (0.55) | ITGA4ESR1ESR2LTA4HCHEK1 | |
| SCHEMBL6597298 | 0.74 | ACHE (0.54) | ESR1ESR2LTA4HCHEK1HRH3 | |
| SCHEMBL7436764 | 0.74 | LTA4H (0.71) | ESR1ESR2LTA4HHRH3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6265575-B1 | THROMBIN INHIBITORS | ELI LILLY AND COMPANY | 2001-07-24 | — | — | US | disclosed |
| US-6251921-B1 | ADMINISTERING THROMBIN INHIBITING DIAMINE COMPOUND TO MAMMAL | ELI LILLY AND COMPANY | 2001-06-26 | — | — | US | disclosed |
| US-6025382-A | Antithrombotic diamines | ELI LILLY AND COMPANY (US) | 2000-02-15 | — | — | US | disclosed |