Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.59 |
| ▸ | GAA | P10253 | 5/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | MLNR | O43193 | 4/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | IRS1 | P35568 | 1/20 | 0.52 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8230176 | 0.86 | ALDH1A1 (0.66) | ALDH1A1HSD17B10SMN1; SMN2GAAMEN1 | |
| SCHEMBL30338749 | 0.86 | HSD17B10 (0.67) | ALDH1A1HSD17B10SMN1; SMN2GAAMEN1 | |
| SCHEMBL10154020 | 0.86 | HSD17B10 (0.67) | ALDH1A1HSD17B10SMN1; SMN2GAAMEN1 | |
| SCHEMBL4370841 | 0.84 | ALDH1A1 (0.71) | ALDH1A1HSD17B10SMN1; SMN2GAAMEN1 | |
| SCHEMBL8277070 | 0.82 | HSD17B10 (0.62) | ALDH1A1HSD17B10SMN1; SMN2GAAMEN1 | |
| SCHEMBL2651145 | 0.82 | ALDH1A1 (0.73) | ALDH1A1HSD17B10SMN1; SMN2GAAMEN1 | |
| SCHEMBL20657500 | 0.82 | KMT2A (0.67) | ALDH1A1HSD17B10SMN1; SMN2GAAMEN1 | |
| SCHEMBL13212276 | 0.81 | HSD17B10 (0.72) | ALDH1A1HSD17B10SMN1; SMN2GAAMEN1 | |
| Hydrochloric Acid SCHEMBL28787677 | 0.81 | ALDH1A1 (0.71) | ALDH1A1HSD17B10SMN1; SMN2GAAMEN1 | |
| SCHEMBL30048936 | 0.81 | ALDH1A1 (0.71) | ALDH1A1HSD17B10SMN1; SMN2GAAMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1953163-A1 | Pteridinone derivatives as PI3-kinases inhibitors | Boehringer Ingelheim Pharma GmbH & Co. KG (DE) | 2008-08-06 | — | — | EP | disclosed |