Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 7/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | RAF1 | P04049 | 1/20 | 0.42 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | EP300 | Q09472 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CISD1 | Q9NZ45 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8641841 | 1.00 | SERPINE1 (0.56) | SERPINE1CYP1A2CYP2C19CYP2C9RAF1 | |
| SCHEMBL9187618 | 0.92 | SERPINE1 (0.53) | SERPINE1CYP1A2CYP2C19CYP2C9RAF1 | |
| SCHEMBL9435600 | 0.92 | SERPINE1 (0.53) | SERPINE1CYP1A2CYP2C19CYP2C9RAF1 | |
| SCHEMBL9435603 | 0.92 | SERPINE1 (0.53) | SERPINE1CYP1A2CYP2C19CYP2C9RAF1 | |
| SCHEMBL9435397 | 0.92 | SERPINE1 (0.53) | SERPINE1CYP1A2CYP2C19CYP2C9RAF1 | |
| SCHEMBL9184625 | 0.89 | SERPINE1 (0.52) | SERPINE1HRH3MAPTNPSR1KMT2A | |
| SCHEMBL1166080 | 0.89 | SERPINE1 (0.68) | SERPINE1HRH3EP300MAPT | |
| SCHEMBL8639908 | 0.89 | SERPINE1 (0.68) | SERPINE1HRH3EP300MAPT | |
| SCHEMBL1166081 | 0.89 | SERPINE1 (0.68) | SERPINE1HRH3EP300MAPT | |
| SCHEMBL8639912 | 0.89 | SERPINE1 (0.68) | SERPINE1HRH3EP300MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0672036-A1 | PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES | XENOVA LIMITED (GB) | 1995-09-20 | — | — | EP | claimed |
| WO-1994004513-A1 | PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES | XENOVA LIMITED (GB) | 1994-03-03 | — | — | WO | claimed |
| US-5852018-A | Pharmaceutical piperazine compounds | XENOVA LIMITED (GB) | 1998-12-22 | — | — | US | disclosed |
| EP-0672036-A1 | PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES | XENOVA LIMITED (GB) | 1995-09-20 | — | — | EP | disclosed |
| WO-1995021830-A1 | PHARMACEUTICAL PIPERAZIN COMPOUNDS | XENOVA LIMITED (GB) | 1995-08-17 | — | — | WO | disclosed |
| WO-1994004513-A1 | PHARMACEUTICALLY ACTIVE DIKETOPIPERAZINES | XENOVA LIMITED (GB) | 1994-03-03 | — | — | WO | disclosed |