Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 13/20 | 0.45 |
| ▸ | RARA | P10276 | 12/20 | 0.45 |
| ▸ | RARG | P13631 | 12/20 | 0.39 |
| ▸ | RXRA | P19793 | 4/20 | 0.39 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.37 |
| ▸ | RXRB | P28702 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL8513225 | 0.91 | RARB (0.45) | RARBRARARARGRXRACYP26A1 | |
| SCHEMBL9612772 | 0.87 | RARB (0.47) | RARBRARARARGRXRACYP26A1 | |
| SCHEMBL8511400 | 0.81 | RARB (0.47) | RARBRARARARGRXRACYP26A1 | |
| SCHEMBL8514253 | 0.79 | NPC1 (0.55) | RARBRARARARGRXRACYP3A4 | |
| SCHEMBL31060783 | 0.79 | RARB (0.51) | RARBRARARARGRXRACYP26A1 | |
| SCHEMBL8515254 | 0.79 | RARB (0.51) | RARBRARARARGRXRACYP26A1 | |
| SCHEMBL8511696 | 0.75 | RARB (0.44) | RARBRARARARGRXRAMEN1 | |
| SCHEMBL8511483 | 0.75 | RARB (0.46) | RARBRARARARGRXRACYP26A1 | |
| Hydrochloric Acid SCHEMBL8515237 | 0.74 | RARB (0.44) | RARBRARARARGRXRAMEN1 | |
| SCHEMBL8512804 | 0.72 | RARA (0.49) | RARBRARARARGCYP3A4MEN1 |
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-2012069852-A1 | PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF SPHINGOSINE KINASE | ALMAC DISCOVERY LIMITED (GB) | 2012-05-31 | — | — | WO | claimed |