Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 1/20 | 0.49 |
| ▸ | CDK14 | O94921 | 4/20 | 0.49 |
| ▸ | CCNY | Q8ND76 | 4/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALPL | P05186 | 1/20 | 0.47 |
| ▸ | ALPI | P09923 | 1/20 | 0.47 |
| ▸ | ALPG | P10696 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5266768 | 0.90 | CLK1 (0.52) | CLK1CDK14CCNYTSHRALPL | |
| SCHEMBL5269902 | 0.88 | CLK1 (0.51) | CLK1CDK14CCNYTSHRALPL | |
| SCHEMBL5271991 | 0.87 | CDK14 (0.55) | CLK1CDK14CCNYTSHRALPL | |
| SCHEMBL4293839 | 0.84 | PAX8 (0.59) | CLK1CDK14CCNYTSHRALPL | |
| SCHEMBL5271516 | 0.84 | SMYD3 (0.55) | CLK1CDK14CCNYPKMTSHR | |
| SCHEMBL5267481 | 0.83 | MDM4 (0.49) | PKMPOLBMEN1KMT2A | |
| SCHEMBL4283194 | 0.83 | PAX8 (0.65) | CLK1CDK14CCNYTSHRPOLB | |
| SCHEMBL5273255 | 0.83 | GABRD (0.50) | CLK1CDK14CCNYTSHRALPL | |
| SCHEMBL4284373 | 0.83 | CDK14 (0.48) | CLK1CDK14CCNYTSHRALPL | |
| SCHEMBL4292708 | 0.83 | CDK14 (0.48) | CLK1CDK14CCNYPKMTSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1847531-A1 | PYRAZOLE COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2007-10-24 | — | — | EP | disclosed |