Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL1936956 | 1.00 | ALDH1A1 (0.32) | ALDH1A1GAACYP1A2CYP2D6MAPT | |
| SCHEMBL9886504 | 1.00 | ALDH1A1 (0.32) | ALDH1A1GAACYP1A2CYP2D6MAPT | |
| SCHEMBL1945616 | 0.83 | ALDH1A1 (0.37) | ALDH1A1GAACYP1A2CYP2D6MAPT | |
| SCHEMBL1943801 | 0.82 | DPP4 (0.30) | — | |
| SCHEMBL1943802 | 0.82 | DPP4 (0.30) | — | |
| SCHEMBL9886503 | 0.82 | DPP4 (0.30) | — | |
| SCHEMBL12539977 | 0.76 | ALDH1A1 (0.35) | ALDH1A1GAAMAPT | |
| SCHEMBL10199255 | 0.76 | LMNA (0.42) | ALDH1A1MAPT | |
| SCHEMBL1944352 | 0.76 | MAPT (0.40) | ALDH1A1GAACYP1A2CYP2D6MAPT | |
| SCHEMBL1942929 | 0.76 | PKM (0.35) | ALDH1A1CYP1A2CYP2D6MAPTCYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-9732070-B2 | Protein kinase C inhibitors and uses thereof | RIGEL PHARMACEUTICALS, INC. (US) | 2017-08-15 | — | — | US | disclosed |