Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | RORC | P51449 | 10/20 | 0.42 |
| ▸ | RORA | P35398 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 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 | |
|---|---|---|---|---|
| SCHEMBL10455034 | 0.81 | PSIP1 (0.74) | PSIP1GAAALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL10180779 | 0.80 | GAA (0.59) | PSIP1GAARORCALDH1A1 | |
| SCHEMBL16441817 | 0.78 | PSIP1 (0.52) | PSIP1GAARORCRORAALDH1A1 | |
| SCHEMBL19987486 | 0.78 | PSIP1 (0.52) | PSIP1GAARORCRORAALDH1A1 | |
| SCHEMBL17289163 | 0.77 | ENPP2 (0.50) | CYP3A4PTGS2 | |
| SCHEMBL30026174 | 0.77 | PSIP1 (0.50) | PSIP1GAARORCRORAALDH1A1 | |
| SCHEMBL18440551 | 0.77 | GAA (0.55) | PSIP1GAARORCRORAALDH1A1 | |
| SCHEMBL28554996 | 0.77 | PSIP1 (0.50) | PSIP1GAARORCRORAALDH1A1 | |
| SCHEMBL10179790 | 0.77 | PSIP1 (0.50) | PSIP1GAAALDH1A1 | |
| SCHEMBL16232116 | 0.77 | GAA (0.55) | PSIP1GAARORCRORAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104837843-A | Imidazopyridazine derivatives as GABAA receptor modulators | PFIZER | 2015-08-12 | — | — | CN | disclosed |