Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.34 |
| ▸ | BTK | Q06187 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.32 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9901615 | 0.95 | ALDH1A1 (0.40) | MAPK1ALDH1A1KDM4EHSD17B10GSK3A | |
| SCHEMBL9902320 | 0.88 | ALDH1A1 (0.39) | MAPK1ALDH1A1KDM4EHSD17B10GSK3A | |
| SCHEMBL9902595 | 0.75 | SMN1; SMN2 (0.47) | MAPK1ALDH1A1HTTGAASMN1; SMN2 | |
| SCHEMBL9902313 | 0.71 | SCN10A (0.39) | EPHX1JAK2JAK1 | |
| SCHEMBL9902315 | 0.70 | EPHX1 (0.49) | MAPK1ALDH1A1GAAPKMMAPT | |
| SCHEMBL9901463 | 0.70 | ALDH1A1 (0.53) | ALDH1A1KDM4EHTTGAASMN1; SMN2 | |
| SCHEMBL17271394 | 0.70 | ALDH1A1 (0.32) | ALDH1A1SMN1; SMN2EPHX1TSHR | |
| SCHEMBL9903230 | 0.69 | ALDH1A1 (0.54) | ALDH1A1 | |
| SCHEMBL9901315 | 0.69 | ALDH1A1 (0.50) | MAPK1ALDH1A1GAASMN1; SMN2MEN1 | |
| SCHEMBL9903633 | 0.68 | DRD4 (0.39) | ALDH1A1HTTSMN1; SMN2MEN1KMT2A |
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-2649048-A1 | MULTIFUNCTIONAL NITROXIDE DERIVATIVES AND USES THEREOF | Radikal Therapeutics Inc. (US) | 2013-10-16 | — | — | EP | disclosed |
| WO-2012077108-A1 | MULTIFUNCTIONAL NITROXIDE DERIVATIVES AND USES THEREOF | RADIKAL THERAPEUTICS INC. (US) | 2012-06-14 | — | — | WO | disclosed |