Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 15/20 | 0.71 |
| ▸ | ESR2 | Q92731 | 14/20 | 0.71 |
| ▸ | ENPP1 | P22413 | 3/20 | 0.63 |
| ▸ | ENPP3 | O14638 | 3/20 | 0.63 |
| ▸ | STS | P08842 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL6595594 | 0.92 | ESR1 (0.71) | ESR1ESR2 | |
| SCHEMBL6596552 | 0.92 | ESR1 (0.70) | ESR1ESR2ENPP1ENPP3 | |
| SCHEMBL7444480 | 0.92 | ESR1 (0.70) | ESR1ESR2ENPP1ENPP3 | |
| SCHEMBL7774305 | 0.88 | ESR1 (0.79) | ESR1ESR2ENPP1ENPP3 | |
| SCHEMBL6597451 | 0.87 | ESR1 (0.77) | ESR1ESR2 | |
| SCHEMBL6597094 | 0.87 | ESR1 (0.72) | ESR1ESR2 | |
| SCHEMBL6598992 | 0.87 | ESR1 (0.77) | ESR1ESR2ENPP1ENPP3 | |
| SCHEMBL6598683 | 0.86 | ESR1 (0.70) | ESR1ESR2ENPP1ENPP3 | |
| SCHEMBL6173615 | 0.85 | ESR1 (0.68) | ESR1ESR2STS | |
| SCHEMBL7768296 | 0.85 | ESR1 (0.71) | ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| EP-0863755-A4 | ANTITHROMBOTIC DIAMINES | LILLY CO ELI (US) | 1999-01-20 | — | — | EP | disclosed |
| EP-0863755-A1 | ANTITHROMBOTIC DIAMINES | ELI LILLY AND COMPANY (US) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997025033-A1 | ANTITHROMBOTIC DIAMINES | ELI LILLY AND COMPANY (US) | 1997-07-17 | — | — | WO | disclosed |