Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | GPR183 | P32249 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP4 | P49662 | 1/20 | 0.36 |
| ▸ | CASP5 | P51878 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20133743 | 0.85 | GAA (0.57) | ADRB1GAAKMT2AMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6410332 | 0.82 | FAAH (0.33) | TDP1KMT2AMEN1 | |
| SCHEMBL18076484 | 0.78 | GAA (0.53) | GAAKMT2AMEN1ALDH1A1 | |
| SCHEMBL25425946 | 0.76 | QPCT (0.44) | ADRB1KMT2AMEN1PKMALDH1A1 | |
| SCHEMBL29194592 | 0.76 | PKM (0.46) | KMT2AMEN1PKMALDH1A1 | |
| SCHEMBL30854970 | 0.76 | QPCT (0.44) | ADRB1KMT2AMEN1PKMALDH1A1 | |
| SCHEMBL30245048 | 0.76 | PKM (0.46) | KMT2AMEN1PKMALDH1A1 | |
| SCHEMBL11628726 | 0.76 | ADRB1 (0.56) | ADRB1TDP1KMT2AMEN1GPR183 | |
| SCHEMBL28830636 | 0.75 | HRH2 (0.38) | ADRB1KMT2AMEN1HTR2C | |
| SCHEMBL25426716 | 0.73 | PKM (0.43) | KMT2AMEN1PKMALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000008005-A2 | PIPERAZINONE DERIVATIVES | MERCK PATENT GMBH (DE) | 2000-02-17 | — | — | WO | disclosed |