Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 18/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 18/20 | 0.58 |
| ▸ | F2 | P00734 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | PLD2 | O14939 | 1/20 | 0.52 |
| ▸ | KDM1A | O60341 | 1/20 | 0.52 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | C5 | P01031 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | FYN | P06241 | 1/20 | 0.52 |
| ▸ | PGR | P06401 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6592408 | 0.95 | ESR1 (0.65) | ESR1ESR2F2MEN1PLD2 | |
| SCHEMBL6172249 | 0.93 | ESR1 (0.50) | ESR1ESR2F2 | |
| SCHEMBL6594992 | 0.93 | ESR1 (0.55) | ESR1ESR2F2 | |
| SCHEMBL6171170 | 0.93 | ESR1 (0.59) | ESR1ESR2F2MEN1PLD2 | |
| SCHEMBL6173290 | 0.92 | ESR1 (0.52) | ESR1ESR2F2 | |
| SCHEMBL6596715 | 0.91 | ESR1 (0.60) | ESR1ESR2F2MEN1PLD2 | |
| SCHEMBL6597513 | 0.90 | ESR1 (0.59) | ESR1ESR2F2 | |
| SCHEMBL6174247 | 0.90 | F2 (0.57) | ESR1ESR2F2 | |
| SCHEMBL7417917 | 0.90 | ESR1 (0.51) | ESR1ESR2F2MEN1PLD2 | |
| SCHEMBL7774159 | 0.89 | F2 (0.65) | ESR1ESR2F2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0980366-B1 | ANTITHROMBOTIC AGENTS | LILLY CO ELI (US) | 2004-06-09 | — | — | EP | disclosed |
| US-6271227-B1 | ANTICOAGULANTS | ELI LILLY AND COMPANY | 2001-08-07 | — | — | US | 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 |