Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MYC | P01106 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CDC25B | P30305 | 2/20 | 0.44 |
| ▸ | CDC25A | P30304 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| SCHEMBL7931235 | 0.83 | ALDH1A1 (0.50) | AKR1C3KDM4EALDH1A1MAPTPOLB | |
| SCHEMBL195812 | 0.81 | CYP1A2 (0.44) | AKR1C3KDM4EALDH1A1CDC25BCDC25A | |
| SCHEMBL809324 | 0.79 | AKR1C3 (0.72) | AKR1C3KDM4EMYCALDH1A1MAPT | |
| SCHEMBL1666651 | 0.78 | ALDH1A1 (0.65) | AKR1C3KDM4EMYCALDH1A1MAPT | |
| SCHEMBL6057040 | 0.77 | AKR1C3 (0.69) | AKR1C3KDM4EMYCALDH1A1MAPT | |
| SCHEMBL6056938 | 0.77 | AKR1C3 (0.69) | AKR1C3KDM4EMYCALDH1A1MAPT | |
| SCHEMBL6597786 | 0.76 | AKR1C3 (0.55) | AKR1C3ALDH1A1MAPTPOLBCDC25B | |
| SCHEMBL29683548 | 0.76 | AKR1C3 (0.55) | AKR1C3ALDH1A1MAPTPOLBCDC25B | |
| SCHEMBL163745 | 0.74 | AKR1C3 (0.59) | AKR1C3KDM4EMYCALDH1A1MAPT | |
| SCHEMBL1129191 | 0.74 | PRNP (0.59) | AKR1C3KDM4EALDH1A1MAPTPOLB |
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-2012017977-A1 | NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING SAME | CANON KABUSHIKI KAISHA (JP) | 2012-02-09 | — | — | WO | disclosed |