Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL18015923 | 0.88 | ADORA2A (0.46) | KDM4ECYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL8326923 | 0.81 | KDM4E (0.61) | KDM4ECYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL8330251 | 0.75 | DUSP10 (0.45) | KDM4ECYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL8326631 | 0.74 | KDM4E (0.43) | KDM4ECYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL8327283 | 0.73 | CYP2C19 (0.42) | KDM4ECYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL16405734 | 0.72 | KDM4E (0.38) | KDM4ECYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL8329211 | 0.71 | KDM4E (0.43) | KDM4ECYP2C9CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL17994947 | 0.71 | GABRG2 (0.53) | KDM4ECYP2C9CYP2C19CYP3A4CYP2D6 | |
| Methane SCHEMBL10489046 | 0.70 | L3MBTL1 (0.50) | KDM4ECYP2C9CYP2C19CYP1A2SMN1; SMN2 | |
| SCHEMBL8329431 | 0.70 | CCNA2 (0.44) | KDM4ECYP2C9CYP2C19CYP3A4CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0915879-A1 | NOVEL COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 1999-05-19 | — | — | EP | claimed |
| WO-1998001449-A1 | NOVEL COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1998-01-15 | — | — | WO | claimed |
| EP-0915879-A1 | NOVEL COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 1999-05-19 | — | — | EP | disclosed |
| WO-1998001449-A1 | NOVEL COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1998-01-15 | — | — | WO | disclosed |