Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 6/20 | 0.49 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | VCP | P55072 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | TTBK1 | Q5TCY1 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13730481 | 0.83 | BCL6 (0.53) | GAAALDH1A1CYP3A4ALOX15TDP1 | |
| SCHEMBL1624893 | 0.81 | MAPKAPK2 (0.44) | CDK1KDRALK | |
| SCHEMBL7692930 | 0.75 | AURKA (0.45) | AURKAGAAALDH1A1RECQLCYP3A4 | |
| SCHEMBL7688609 | 0.75 | AURKA (0.43) | AURKAGAAALDH1A1RECQLSYK | |
| SCHEMBL11429763 | 0.75 | MAPT (0.59) | AURKAGAAALDH1A1CYP3A4TDP1 | |
| SCHEMBL2411693 | 0.74 | AURKA (0.53) | AURKAGAAALDH1A1RECQLSYK | |
| SCHEMBL13202023 | 0.74 | MAPK1 (0.52) | AURKAGAAALDH1A1RECQLCYP3A4 | |
| SCHEMBL6384523 | 0.73 | EGFR (0.38) | SYKHTTTTBK1TTBK2EGFR | |
| SCHEMBL4902552 | 0.73 | RAB9A (0.51) | AURKAGAAALDH1A1MAPTATM | |
| SCHEMBL5027038 | 0.71 | CA12 (0.62) | AURKAGAAALDH1A1RECQLCYP3A4 |
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-2011163355-A1 | FUSED HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASES (PDES) INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-12-29 | — | — | WO | disclosed |