Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7011506 | 0.97 | MEN1 (0.55) | MEN1KMT2ATDP1ALDH1A1CYP1A2 | |
| SCHEMBL7017586 | 0.94 | MEN1 (0.57) | MEN1KMT2ATDP1ALDH1A1CYP1A2 | |
| SCHEMBL7014429 | 0.93 | MEN1 (0.54) | MEN1KMT2ATDP1ALDH1A1CYP1A2 | |
| SCHEMBL7015787 | 0.93 | MEN1 (0.51) | MEN1KMT2ATDP1ALDH1A1CYP1A2 | |
| SCHEMBL7018370 | 0.92 | MEN1 (0.50) | MEN1KMT2ATDP1ALDH1A1CYP1A2 | |
| SCHEMBL7015657 | 0.92 | TP53 (0.52) | MEN1KMT2ATDP1ALDH1A1CYP3A4 | |
| SCHEMBL7013147 | 0.92 | MEN1 (0.50) | MEN1KMT2ATDP1ALDH1A1CYP1A2 | |
| SCHEMBL7013547 | 0.90 | PTGDR2 (0.52) | MEN1KMT2ATDP1ALDH1A1PTGDR2 | |
| SCHEMBL7013156 | 0.90 | DAO (0.50) | MEN1KMT2ATDP1ALDH1A1PTGDR2 | |
| SCHEMBL7010770 | 0.89 | MEN1 (0.47) | MEN1KMT2ATDP1ALDH1A1CYP1A2 |
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-0733633-B1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-05-28 | — | — | EP | disclosed |
| US-5753664-A | ANTITUMOR AGENTS, PYRIMIDONES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-05-19 | — | — | US | disclosed |
| EP-0733633-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-25 | — | — | EP | disclosed |