Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | F2R | P25116 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | CRACR2A | Q9BSW2 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 2/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6615953 | 0.97 | CHRM5 (0.41) | CHRM5CHRM1CHRM3F2RNPC1 | |
| SCHEMBL6618849 | 0.92 | CHRM5 (0.40) | CHRM5CHRM1CHRM3F2RNPC1 | |
| SCHEMBL6617735 | 0.90 | PKM (0.42) | CHRM5CHRM1CHRM3F2RNPC1 | |
| SCHEMBL6603129 | 0.88 | TP53 (0.41) | CHRM5CHRM1CHRM3RAB9ACRACR2A | |
| SCHEMBL6617490 | 0.88 | PPARG (0.41) | CHRM5CHRM1CHRM3CRACR2APKM | |
| SCHEMBL6620323 | 0.87 | TYK2 (0.41) | F2RCRACR2A | |
| SCHEMBL6622540 | 0.87 | RAB9A (0.44) | NPC1RAB9APKMMAPTROCK2 | |
| SCHEMBL6614768 | 0.86 | PKM (0.43) | NPC1RAB9ACRACR2APKMMAPT | |
| SCHEMBL6683281 | 0.86 | MAPT (0.40) | CHRM5CHRM1CHRM3RAB9ACRACR2A | |
| SCHEMBL6617620 | 0.85 | CNR1 (0.42) | CRACR2APKMMAPTTP53ROCK2 |
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 |