Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.46 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | CTSS | P25774 | 1/20 | 0.46 |
| ▸ | CTSC | P53634 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTR1E | P28566 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9901315 | 0.91 | ALDH1A1 (0.50) | CTSLCTSBCTSSCTSCALDH1A1 | |
| SCHEMBL9902595 | 0.85 | SMN1; SMN2 (0.47) | CTSLCTSBCTSSCTSCALDH1A1 | |
| SCHEMBL9902968 | 0.85 | EPHX1 (0.41) | CTSLCTSBCTSSCTSCMAPK1 | |
| SCHEMBL9902487 | 0.84 | ALDH1A1 (0.47) | ALDH1A1EPHX2RAB9ANPC1 | |
| SCHEMBL9902117 | 0.79 | ALDH1A1 (0.46) | ALDH1A1KMT2ADRD2DRD4DRD3 | |
| SCHEMBL9901727 | 0.76 | SCN10A (0.38) | — | |
| SCHEMBL9903173 | 0.76 | EPHX1 (0.47) | ALDH1A1MAPK1EPHX2EPHX1 | |
| SCHEMBL9902657 | 0.74 | ALDH1A1 (0.52) | ALDH1A1EPHX2 | |
| SCHEMBL9902320 | 0.73 | ALDH1A1 (0.39) | CTSLCTSBCTSSCTSCALDH1A1 | |
| SCHEMBL9902315 | 0.71 | EPHX1 (0.49) | ALDH1A1MAPK1EPHX2MAPTRAB9A |
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 |