Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 2/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | TAOK1 | Q7L7X3 | 2/20 | 0.36 |
| ▸ | TAOK3 | Q9H2K8 | 2/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.35 |
| ▸ | F2R | P25116 | 2/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6614960 | 0.98 | HRH3 (0.39) | HRH3MEN1CYP1A2CYP3A4GAA | |
| SCHEMBL6616492 | 0.94 | HRH3 (0.38) | HRH3MEN1CYP1A2CYP3A4GAA | |
| SCHEMBL6622840 | 0.90 | PTGES (0.42) | HRH3PTGESEPHX2TAOK1TAOK3 | |
| SCHEMBL6616066 | 0.89 | KMT2A (0.39) | MEN1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL6617610 | 0.87 | KMT2A (0.40) | MEN1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL6617506 | 0.87 | HRH3 (0.41) | HRH3MEN1KMT2APTGESEPHX2 | |
| SCHEMBL6621376 | 0.87 | KMT2A (0.39) | MEN1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL6614362 | 0.87 | HRH3 (0.43) | HRH3MEN1GAAKMT2AEPHX2 | |
| SCHEMBL6618534 | 0.87 | NPY2R (0.38) | MEN1CYP1A2CYP3A4GAACYP2D6 | |
| SCHEMBL6617170 | 0.86 | KMT2A (0.45) | MEN1CYP1A2CYP3A4GAACYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1458379-A1 | HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | Pharmacia Italia S.p.A. (IT) | 2004-09-22 | — | — | EP | disclosed |
| WO-2003051358-A1 | HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | PHARMACIA ITALIA SPA (IT) | 2003-06-26 | — | — | WO | disclosed |