Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 16/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 16/20 | 0.61 |
| ▸ | CNR1 | P21554 | 2/20 | 0.53 |
| ▸ | CNR2 | P34972 | 1/20 | 0.53 |
| ▸ | F2 | P00734 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | PLD2 | O14939 | 1/20 | 0.51 |
| ▸ | KDM1A | O60341 | 1/20 | 0.51 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | C5 | P01031 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | FYN | P06241 | 1/20 | 0.51 |
| ▸ | PGR | P06401 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6171170 | 0.86 | ESR1 (0.59) | ESR1ESR2CNR1F2MEN1 | |
| SCHEMBL6171904 | 0.86 | ESR1 (0.56) | ESR1ESR2CNR1CNR2F2 | |
| SCHEMBL6172078 | 0.85 | ESR1 (0.73) | ESR1ESR2CNR1F2MEN1 | |
| SCHEMBL7775991 | 0.85 | ESR1 (0.55) | ESR1ESR2CNR1CNR2F2 | |
| SCHEMBL6597230 | 0.84 | F2 (0.73) | ESR1ESR2CNR1F2MEN1 | |
| SCHEMBL7423819 | 0.84 | ESR1 (0.48) | ESR1ESR2CNR1CNR2F2 | |
| SCHEMBL7768296 | 0.83 | ESR1 (0.71) | ESR1ESR2F2 | |
| SCHEMBL7773938 | 0.83 | ESR1 (0.75) | ESR1ESR2CNR1F2MEN1 | |
| SCHEMBL6596053 | 0.83 | ESR1 (0.79) | ESR1ESR2CNR1F2MEN1 | |
| SCHEMBL6171704 | 0.81 | F2 (0.75) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1027051-B1 | ANTITHROMBOTIC AGENTS | LILLY CO ELI (US) | 2005-01-05 | — | — | EP | disclosed |
| US-6391901-B1 | Thrombin inhibitors | ELI LILLY AND COMPANY | 2002-05-21 | — | — | US | disclosed |