Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7309781 | 1.00 | ACE (0.44) | ACELMNAFKBP1AKMT2APOLB | |
| SCHEMBL11084683 | 0.85 | ACE (0.41) | ACELMNAKMT2APOLBCYP2D6 | |
| SCHEMBL7311432 | 0.77 | PKM (0.45) | ACELMNAPKMGAAITGB3 | |
| SCHEMBL7311444 | 0.77 | PKM (0.45) | ACELMNAPKMGAAITGB3 | |
| SCHEMBL8988835 | 0.71 | ACE (0.39) | ACELMNAKMT2APOLBCYP2D6 | |
| SCHEMBL8988818 | 0.71 | ACE (0.39) | ACELMNAKMT2APOLBCYP2D6 | |
| SCHEMBL691684 | 0.68 | PKM (0.51) | KMT2APKMGAAALDH1A1 | |
| Hydrochloric Acid SCHEMBL7277753 | 0.68 | PKM (0.44) | ACEKMT2APOLBCYP2D6CYP2C9 | |
| SCHEMBL7366324 | 0.68 | PKM (0.44) | KMT2APKMGAAITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL7277734 | 0.68 | PKM (0.44) | ACEKMT2APOLBCYP2D6CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0643072-B1 | 2-Piperazinone compounds and their use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1999-02-24 | — | — | EP | disclosed |
| US-5550131-A | ANTITHROMBOTIC AGENT | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-08-27 | — | — | US | disclosed |
| EP-0643072-A1 | 2-Piperazinone compounds and their use | Takeda Chemical Industries, Ltd. (JP) | 1995-03-15 | — | — | EP | disclosed |