Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 3/20 | 0.47 |
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7012231 | 0.83 | TRPA1 (0.48) | NPSR1MAPTCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7018370 | 0.82 | MEN1 (0.50) | MAOAMAOBKMT2ANPSR1MAPT | |
| SCHEMBL7018222 | 0.79 | TDP1 (0.49) | MAOAMAOBKMT2ANPSR1MAPT | |
| SCHEMBL7019084 | 0.76 | MAOA (0.46) | MAOAMAOBKMT2ANPSR1MAPT | |
| SCHEMBL7011506 | 0.75 | MEN1 (0.55) | KMT2AMAPTMEN1CYP1A2CYP2D6 | |
| SCHEMBL7014766 | 0.75 | NPC1 (0.58) | MAOBKMT2ANPSR1MAPTCYP1A2 | |
| SCHEMBL7014764 | 0.75 | NPC1 (0.58) | MAOBKMT2ANPSR1MAPTCYP1A2 | |
| SCHEMBL7014540 | 0.74 | DRD2 (0.52) | KMT2ANPSR1MAPTMEN1CYP1A2 | |
| SCHEMBL7008944 | 0.74 | CASR (0.45) | HDAC6SMN1; SMN2TRPA1PIK3CDNPC1 | |
| SCHEMBL7101327 | 0.73 | MEN1 (0.60) | KMT2AMAPTMEN1CYP1A2CYP2D6 |
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 |