Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | KCNJ6 | P48051 | 9/20 | 0.43 |
| ▸ | KCNJ5 | P48544 | 9/20 | 0.43 |
| ▸ | KCNJ3 | P48549 | 9/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KDM5A | P29375 | 1/20 | 0.43 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.43 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.43 |
| ▸ | CHRNE | Q04844 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL6615720 | 0.98 | ACHE (0.44) | ACHEKCNJ6KCNJ5KCNJ3MAPT | |
| SCHEMBL6616472 | 0.91 | NPC1 (0.47) | KCNJ6KCNJ5KCNJ3MAPTMEN1 | |
| SCHEMBL6618575 | 0.89 | NPC1 (0.47) | KCNJ6KCNJ5KCNJ3MAPTMEN1 | |
| SCHEMBL6613131 | 0.88 | KCNJ6 (0.42) | KCNJ6KCNJ5KCNJ3RAB9AKDM4E | |
| SCHEMBL6618205 | 0.87 | KDM4E (0.45) | MAPTMEN1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL6614988 | 0.86 | NPC1 (0.50) | KCNJ6KCNJ5KCNJ3MAPTMEN1 | |
| SCHEMBL6616753 | 0.85 | KDM5A (0.43) | MAPTMEN1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL6616676 | 0.85 | KDM5A (0.44) | MAPTMEN1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL6628153 | 0.85 | RAB9A (0.48) | KCNJ6KCNJ5KCNJ3MAPTMEN1 | |
| SCHEMBL6617632 | 0.84 | MAPT (0.47) | MAPTTP53MEN1KMT2AMAPK1 |
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 |