Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 8/20 | 0.59 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | RAF1 | P04049 | 1/20 | 0.45 |
| ▸ | CDK1 | P06493 | 1/20 | 0.45 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8495028 | 1.00 | SERPINE1 (0.59) | SERPINE1HRH3CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8492223 | 0.90 | SERPINE1 (0.59) | SERPINE1CYP1A2CYP2C19HPGDPPARA | |
| SCHEMBL8492220 | 0.90 | SERPINE1 (0.59) | SERPINE1CYP1A2CYP2C19HPGDPPARA | |
| SCHEMBL8838101 | 0.81 | SERPINE1 (0.61) | SERPINE1HRH3HPGDKMT2A | |
| SCHEMBL6379672 | 0.81 | SERPINE1 (0.68) | SERPINE1HRH3CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6379668 | 0.81 | SERPINE1 (0.68) | SERPINE1HRH3CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6378474 | 0.76 | SERPINE1 (0.64) | SERPINE1HRH3KMT2A | |
| SCHEMBL6378470 | 0.76 | SERPINE1 (0.64) | SERPINE1HRH3KMT2A | |
| SCHEMBL2448081 | 0.76 | L3MBTL1 (0.47) | CYP2C19HPGDKMT2A | |
| SCHEMBL6372620 | 0.75 | SERPINE1 (1.00) | SERPINE1HRH3CYP1A2CYP2C9CYP2C19 |
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-0745069-A1 | PHARMACEUTICAL PIPERAZINE COMPOUNDS | XENOVA LIMITED (GB) | 1996-12-04 | — | — | EP | claimed |
| WO-1995021829-A1 | PHARMACEUTICAL PIPERAZINE COMPOUNDS | XENOVA LIMITED (GB) | 1995-08-17 | — | — | WO | claimed |
| US-5902812-A | Pharmaceutical piperazine compounds | XENOVA LIMITED (GB) | 1999-05-11 | — | — | US | disclosed |
| EP-0745069-A1 | PHARMACEUTICAL PIPERAZINE COMPOUNDS | XENOVA LIMITED (GB) | 1996-12-04 | — | — | EP | disclosed |
| WO-1995021829-A1 | PHARMACEUTICAL PIPERAZINE COMPOUNDS | XENOVA LIMITED (GB) | 1995-08-17 | — | — | WO | disclosed |