Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | CDK7 | P50613 | 1/20 | 0.37 |
| ▸ | MAP2K4 | P45985 | 2/20 | 0.36 |
| ▸ | PLK1 | P53350 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18816227 | 0.91 | DGAT2 (0.45) | ALDH1A1MAPK1DGAT2HPGDKMT2A | |
| SCHEMBL30159627 | 0.83 | ALDH1A1 (0.41) | ALDH1A1MAPK1DGAT2HPGDKMT2A | |
| SCHEMBL9904651 | 0.83 | ALDH1A1 (0.41) | ALDH1A1MAPK1DGAT2HPGDKMT2A | |
| SCHEMBL23535808 | 0.80 | DGAT2 (0.46) | ALDH1A1MAPK1DGAT2HPGDKMT2A | |
| SCHEMBL30159713 | 0.80 | DGAT2 (0.46) | ALDH1A1MAPK1DGAT2HPGDKMT2A | |
| SCHEMBL30384306 | 0.79 | DGAT2 (0.45) | ALDH1A1MAPK1DGAT2HPGDKMT2A | |
| SCHEMBL23248573 | 0.79 | MAP2K4 (0.44) | ALDH1A1HPGDCHEK1CDK7MAP2K4 | |
| SCHEMBL30159476 | 0.77 | MAP2K4 (0.54) | ALDH1A1HPGDMAP2K4KMT2AMEN1 | |
| SCHEMBL2671519 | 0.77 | MAP2K4 (0.54) | ALDH1A1HPGDMAP2K4KMT2AMEN1 | |
| SCHEMBL23535683 | 0.75 | ALDH1A1 (0.43) | ALDH1A1HPGDSMN1; SMN2ATMNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021075476-A1 | HETEROCYCLIC COMPOUND | 武田薬品工業株式会社 | 2021-04-22 | — | — | WO | disclosed |