Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.41 |
| ▸ | BPTF | Q12830 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | FPR1 | P21462 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL7020936 | 0.96 | KDM4E (0.43) | ALDH1A1KDM5BKDM4EBPTFHPGD | |
| Potassium Ion SCHEMBL3677975 | 0.73 | KDM4E (0.42) | ALDH1A1KDM5BKDM4EBPTFHPGD | |
| SCHEMBL3679657 | 0.71 | ALDH1A1 (0.55) | ALDH1A1KDM5BKDM4EBPTFHPGD | |
| SCHEMBL1161698 | 0.70 | KDM4E (0.40) | ALDH1A1KDM5BKDM4EBPTFHPGD | |
| SCHEMBL17424827 | 0.64 | KDM4E (0.53) | ALDH1A1KDM4EBPTFHPGDMAPK1 | |
| SCHEMBL10832675 | 0.64 | ACHE (0.45) | ALDH1A1KDM5BKDM4EBPTFHPGD | |
| SCHEMBL11449986 | 0.62 | GAA (0.54) | ALDH1A1KDM4EHPGDHSD17B10MAPK1 | |
| SCHEMBL18703579 | 0.62 | HPGD (0.49) | ALDH1A1KDM4EHPGDHSD17B10KMT2A | |
| SCHEMBL7018863 | 0.61 | KDM4E (0.33) | ALDH1A1KDM4EHPGDHTTNPC1 | |
| SCHEMBL11449432 | 0.61 | ALDH1A1 (0.40) | ALDH1A1KDM5BKDM4EHPGDHSD17B10 |
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 2 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 |
| EP-0733633-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-25 | — | — | EP | disclosed |