Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 8/20 | 0.80 |
| ▸ | MAOB | P27338 | 2/20 | 0.80 |
| ▸ | ACHE | P22303 | 1/20 | 0.80 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.74 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.74 |
| ▸ | PDE4A | P27815 | 1/20 | 0.72 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.72 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.72 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.72 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.72 |
| ▸ | MEN1 | O00255 | 3/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.72 |
| ▸ | MAPT | P10636 | 2/20 | 0.72 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.67 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.65 |
| ▸ | HPGD | P15428 | 2/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL16740655 | 1.00 | ABCG2 (0.80) | ABCG2MAOBACHEABCB1ABCC1 | |
| SCHEMBL17549125 | 0.90 | MAPT (0.72) | ABCG2MAOBACHEABCB1ABCC1 | |
| SCHEMBL2944203 | 0.89 | ABCG2 (0.76) | ABCG2MAOBACHEABCB1ABCC1 | |
| SCHEMBL25191764 | 0.89 | ABCG2 (0.76) | ABCG2MAOBACHEABCB1ABCC1 | |
| SCHEMBL2944206 | 0.89 | ABCG2 (0.76) | ABCG2MAOBACHEABCB1ABCC1 | |
| SCHEMBL25202039 | 0.89 | ABCG2 (0.76) | ABCG2MAOBACHEABCB1ABCC1 | |
| SCHEMBL25191295 | 0.89 | PTGS1 (0.85) | ABCG2MAOBACHEMEN1KMT2A | |
| SCHEMBL25223438 | 0.89 | MAOB (1.00) | ABCG2MAOBACHEPDE4APDE4B | |
| SCHEMBL634191 | 0.89 | MAOB (1.00) | ABCG2MAOBACHEPDE4APDE4B | |
| SCHEMBL31233232 | 0.89 | ABCG2 (0.76) | ABCG2MAOBACHEABCB1ABCC1 |
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-2015075051-A1 | ALLOSTERIC INHIBITORS OF ATYPICAL PROTEIN KINASES C | UNIVERSITAET DES SAARLANDES (DE) | 2015-05-28 | — | — | WO | disclosed |