Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 9/20 | 0.59 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.58 |
| ▸ | ESR1 | P03372 | 6/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | UBE2N | P61088 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7452024 | 0.92 | F2 (0.56) | F2ITGA4ESR1ESR2UBE2N | |
| SCHEMBL6595726 | 0.91 | F2 (0.61) | F2ITGA4ESR1ESR2HRH3 | |
| SCHEMBL6596926 | 0.91 | ITGA4 (0.69) | F2ITGA4ESR1ESR2 | |
| SCHEMBL6596335 | 0.90 | ITGA4 (0.68) | F2ITGA4ESR1ESR2 | |
| SCHEMBL6595883 | 0.88 | F2 (0.58) | F2ITGA4ESR1ESR2UBE2N | |
| SCHEMBL6172878 | 0.88 | ESR1 (0.66) | F2ITGA4ESR1ESR2UBE2N | |
| SCHEMBL6595837 | 0.87 | F2 (0.76) | F2ITGA4ESR1ESR2HRH3 | |
| SCHEMBL7982501 | 0.87 | F2 (0.67) | F2ITGA4ESR1ESR2 | |
| SCHEMBL6597629 | 0.87 | F2 (0.67) | F2ITGA4ESR1ESR2 | |
| SCHEMBL7774025 | 0.87 | F2 (0.65) | F2ITGA4ESR1ESR2 |
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-0863755-B1 | ANTITHROMBOTIC DIAMINES | LILLY CO ELI (US) | 2004-12-15 | — | — | EP | disclosed |
| 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 |