Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RGS4 | P49798 | 1/20 | 0.42 |
| ▸ | RGS8 | P57771 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | UBE2N | P61088 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6428843 | 0.92 | NR1H2 (0.52) | MAPTNR1H2NR1H3ALDH1A1KMT2A | |
| SCHEMBL6427000 | 0.85 | NR1H2 (0.60) | MAPTHTTNR1H2NR1H3ALDH1A1 | |
| SCHEMBL6428883 | 0.83 | NR1H2 (0.48) | MAPTHTTNR1H2NR1H3ALDH1A1 | |
| SCHEMBL6426786 | 0.83 | MAPT (0.46) | MAPTTHRBHTTNR1H2NR1H3 | |
| SCHEMBL6426484 | 0.82 | APAF1 (0.52) | MAPTNR1H2NR1H3ALDH1A1KMT2A | |
| SCHEMBL6429547 | 0.81 | CMA1 (0.54) | MAPTNR1H2NR1H3ALDH1A1CASP3 | |
| SCHEMBL6427927 | 0.79 | MAPT (0.52) | MAPTHTTNR1H2NR1H3ALDH1A1 | |
| SCHEMBL6427394 | 0.79 | NR1H2 (0.51) | NR1H2NR1H3CES2BCHECES1 | |
| SCHEMBL7558814 | 0.78 | CES2 (0.53) | MAPTTHRBHTTNR1H2NR1H3 | |
| SCHEMBL5235803 | 0.78 | CYP1A2 (0.51) | MAPTTHRBHTTALDH1A1CASP3 |
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-2005024755-A2 | MEDICAMENTS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS OR DIABETES | DECIPHERA PHARMACEUTICALS, LLC. (US) | 2005-03-17 | — | — | WO | disclosed |