Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 3/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | ACACA | Q13085 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL8916801 | 0.84 | ATR (0.37) | ATREPHX2ALDH1A1HTR2CHRH4 | |
| SCHEMBL8916060 | 0.82 | PRKD1 (0.40) | ATREPHX2ALDH1A1HTR2CHRH4 | |
| SCHEMBL8916074 | 0.80 | HRH4 (0.39) | ATREPHX2ALDH1A1HTR2CHRH4 | |
| SCHEMBL8915788 | 0.79 | HTR2C (0.40) | EPHX2HTR2C | |
| SCHEMBL8915723 | 0.79 | ATR (0.36) | ATRALDH1A1HTR2CHRH4ACACB | |
| SCHEMBL8917894 | 0.76 | HTR2C (0.38) | EPHX2HTR2CHRH4ADRA1AADRA1B | |
| SCHEMBL27786900 | 0.74 | ALDH1A1 (0.39) | EPHX2ALDH1A1HTR2C | |
| SCHEMBL4826186 | 0.71 | PRKCQ (0.41) | ATRHRH4ADRA1AADRA1B | |
| SCHEMBL4738517 | 0.68 | ADRA1A (0.36) | HRH4ACACBACACAADRA1AADRA1B | |
| SCHEMBL8793256 | 0.67 | POLB (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5686610-A | Pyridyl piperazine compound | PHARMACIA & UPJOHN COMPANY (US) | 1997-11-11 | — | — | US | disclosed |