Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 2/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28831366 | 0.79 | ALDH1A1 (0.33) | ALDH1A1CYP2D6CYP1A2HIF1A | |
| SCHEMBL7961619 | 0.69 | GAA (0.42) | ALDH1A1MIFMAPTBRD4 | |
| SCHEMBL9285114 | 0.63 | — | — | |
| SCHEMBL31668636 | 0.63 | DNTT (0.34) | ALDH1A1CYP2D6MAPTITGA4BRD4 | |
| SCHEMBL7964375 | 0.63 | BRD4 (0.34) | ALDH1A1CYP2D6CYP1A2HIF1AMAPK1 | |
| SCHEMBL10701200 | 0.61 | MAPT (0.37) | ALDH1A1MAPT | |
| SCHEMBL4384894 | 0.61 | KDM4E (0.36) | ALDH1A1MAPTMAPK1 | |
| SCHEMBL17625113 | 0.61 | ALDH1A1 (0.43) | ALDH1A1CYP2D6CYP1A2HIF1AMAPT | |
| SCHEMBL16267227 | 0.61 | ALDH1A1 (0.39) | ALDH1A1CYP2D6CYP1A2HIF1AMAPT | |
| SCHEMBL30647307 | 0.61 | ALDH1A1 (0.39) | ALDH1A1CYP2D6CYP1A2HIF1AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6215016-B1 | HEMATOPOIETIC AGENTS; PREVENTING CYTOPENIA | TORAY INDUSTRIES, INC. (JP) | 2001-04-10 | — | — | US | disclosed |
| EP-0841063-A1 | KETONE DERIVATIVES AND MEDICINAL USE THEREOF | TORAY INDUSTRIES, INC. (JP) | 1998-05-13 | — | — | EP | disclosed |