Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 19/20 | 0.79 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | THPO | P40225 | 1/20 | 0.53 |
| ▸ | MTOR | P42345 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7439885 | 0.88 | DRD1 (1.00) | DRD1KDM4ETP53CYP3A4CYP2D6 | |
| SCHEMBL7445752 | 0.88 | DRD1 (1.00) | DRD1KDM4ETP53CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7320564 | 0.87 | DRD1 (0.97) | DRD1KDM4ETP53CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9670199 | 0.87 | DRD1 (0.97) | DRD1KDM4ETP53CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL8829240 | 0.87 | DRD1 (0.97) | DRD1KDM4ETP53CYP3A4CYP2D6 | |
| SCHEMBL7447531 | 0.78 | DRD1 (0.74) | DRD1KDM4ETP53CYP3A4CYP2D6 | |
| SCHEMBL7440749 | 0.78 | DRD1 (0.74) | DRD1KDM4ETP53CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7442166 | 0.77 | DRD1 (0.72) | DRD1KDM4ETP53CYP3A4CYP2D6 | |
| SCHEMBL9038200 | 0.77 | DRD1 (0.77) | DRD1KDM4ETP53CYP3A4CYP2D6 | |
| SCHEMBL10379926 | 0.77 | DRD1 (0.77) | DRD1KDM4ETP53CYP3A4CYP2D6 |
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-2021021922-A1 | COMPOUNDS AND METHODS FOR TREATING FIBROTIC PATHOLOGIES | MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) | 2021-02-04 | — | — | WO | disclosed |