Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APAF1 | O14727 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.45 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.45 |
| ▸ | RAD51 | Q06609 | 5/20 | 0.44 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
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 | 0.89 | NR1H2 (0.52) | KMT2AMAPTALDH1A1TP53BCHE | |
| SCHEMBL6428883 | 0.84 | NR1H2 (0.48) | KMT2AMAPTALDH1A1BCHECES1 | |
| SCHEMBL6427927 | 0.83 | MAPT (0.52) | KMT2ACYP1A2MAPTALDH1A1NR1H2 | |
| SCHEMBL6427000 | 0.82 | NR1H2 (0.60) | KMT2ACYP1A2CYP3A4CYP2D6MAPT | |
| SCHEMBL6426845 | 0.82 | MAPT (0.50) | KMT2ACYP1A2CYP3A4MAPTALDH1A1 | |
| SCHEMBL6444746 | 0.81 | RAD51 (0.50) | APAF1KMT2ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28080842 | 0.81 | APAF1 (0.57) | APAF1KMT2ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6429372 | 0.79 | SMN1; SMN2 (0.57) | KMT2ACYP1A2CYP3A4CYP2D6MAPT | |
| SCHEMBL6429547 | 0.79 | CMA1 (0.54) | KMT2AMAPTALDH1A1NR1H2NR1H3 | |
| SCHEMBL6427394 | 0.77 | NR1H2 (0.51) | BCHECES1NR1H2NR1H3 |
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 |