Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARA | P10276 | 10/20 | 0.64 |
| ▸ | RARB | P10826 | 9/20 | 0.64 |
| ▸ | RARG | P13631 | 9/20 | 0.53 |
| ▸ | RXRA | P19793 | 7/20 | 0.43 |
| ▸ | TACR3 | P29371 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.42 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.37 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8511378 | 0.86 | RARB (0.54) | RARARARBRARGRXRATACR3 | |
| SCHEMBL8515070 | 0.83 | RARA (0.43) | RARARARBRARGRXRATACR3 | |
| SCHEMBL8513486 | 0.83 | RARB (0.45) | RARARARBRARGRXRAABCB1 | |
| SCHEMBL8515374 | 0.77 | RARB (0.60) | RARARARBRARGRXRAAKT1 | |
| Hydrochloric Acid SCHEMBL8514603 | 0.76 | RARA (0.58) | RARARARBRARGAKT1 | |
| Hydrochloric Acid SCHEMBL8612658 | 0.76 | RARA (0.58) | RARARARBRARGAKT1 | |
| SCHEMBL12959653 | 0.75 | RARA (0.62) | RARARARBRARGRXRAABCB1 | |
| SCHEMBL8510992 | 0.72 | RARB (0.66) | RARARARBRARGRXRA | |
| Trifluoroacetic Acid SCHEMBL8510709 | 0.71 | RARB (0.64) | RARARARBRARGRXRAABCB1 | |
| SCHEMBL8511470 | 0.71 | RARB (0.64) | RARARARBRARGRXRAABCB1 |
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 | disclosed |