Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 5/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6615076 | 0.91 | RAB9A (0.39) | ALDH1A1KDM4EHPGDHSD17B10RAB9A | |
| SCHEMBL6614350 | 0.90 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDHSD17B10RAB9A | |
| SCHEMBL6620646 | 0.89 | KDM5A (0.39) | ALDH1A1KDM4EHPGDHSD17B10RAB9A | |
| SCHEMBL6617202 | 0.89 | ALDH1A1 (0.37) | ALDH1A1KDM4EHPGDHSD17B10RAB9A | |
| SCHEMBL6618882 | 0.88 | ALDH1A1 (0.40) | ALDH1A1KDM4EHPGDHSD17B10RAB9A | |
| SCHEMBL6604908 | 0.87 | GAA (0.38) | ALDH1A1KDM4EHPGDRAB9AMAPK14 | |
| SCHEMBL6616604 | 0.87 | KMT2A (0.34) | ALDH1A1KDM4EHPGDHSD17B10RAB9A | |
| SCHEMBL6615827 | 0.87 | RAB9A (0.38) | KDM4ERAB9ASMN1; SMN2NPC1MAPT | |
| SCHEMBL6608027 | 0.85 | KMT2A (0.39) | RAB9AGAASMN1; SMN2MEN1CYP1A2 | |
| SCHEMBL6616621 | 0.85 | SMN1; SMN2 (0.40) | ALDH1A1KDM4EHPGDHSD17B10RAB9A |
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 | claimed |
| 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 | claimed |