Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | PRKCI | P41743 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2401814 | 0.84 | P2RX7 (0.44) | P2RX7MKNK1SMN1; SMN2CYP3A4CYP2D6 | |
| SCHEMBL4419704 | 0.79 | SMN1; SMN2 (0.48) | P2RX7MKNK1SMN1; SMN2CYP3A4CYP2D6 | |
| SCHEMBL6259328 | 0.77 | SMN1; SMN2 (0.40) | P2RX7MKNK1SMN1; SMN2CYP3A4CYP2D6 | |
| SCHEMBL2857962 | 0.76 | GAA (0.55) | SMN1; SMN2CYP2D6CYP1A2CYP2C19 | |
| SCHEMBL5262945 | 0.76 | CHRNB2 (0.50) | P2RX7MKNK1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL31579540 | 0.76 | CHRNB2 (0.50) | P2RX7MKNK1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7511801 | 0.74 | CYP2C9 (0.46) | P2RX7SMN1; SMN2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5167269 | 0.73 | MDM2 (0.48) | CYP3A4CYP2D6CYP1A2CYP2C19PRKCI | |
| SCHEMBL9272032 | 0.73 | P2RX7 (0.36) | P2RX7MKNK1EPHX2TDO2PRKCI | |
| SCHEMBL5572160 | 0.73 | KDM4E (0.50) | SMN1; SMN2CYP2D6CYP2C9CYP1A2CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009017838-A2 | COMBINATIONS OF JAK-2 INHIBITORS AND OTHER AGENTS | EXELIXIS, INC. (US) | 2009-02-05 | — | — | WO | claimed |
| WO-2008124085-A2 | METHODS OF USING COMBINATIONS OF MEK AND JAK-2 INHIBITORS | EXELIXIS, INC. (US) | 2008-10-16 | — | — | WO | claimed |
| JP-2002241369-A | 4-PYRIMIDINYLAMINOACETAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | DAINIPPON PHARMACEUT CO LTD | 2002-08-28 | — | — | JP | disclosed |