Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 15/20 | 0.45 |
| ▸ | RARA | P10276 | 14/20 | 0.45 |
| ▸ | RARG | P13631 | 14/20 | 0.45 |
| ▸ | RXRA | P19793 | 6/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8515070 | 0.97 | RARA (0.43) | RARBRARARARGRXRAABCB1 | |
| SCHEMBL8515775 | 0.83 | RARA (0.64) | RARBRARARARGRXRAABCB1 | |
| SCHEMBL18961191 | 0.79 | RARA (0.47) | RARBRARARARGRXRAABCB1 | |
| SCHEMBL8514830 | 0.78 | RARA (0.40) | RARBRARARARGRXRA | |
| Trifluoroacetic Acid SCHEMBL8511940 | 0.78 | RARB (0.42) | RARBRARARARGRXRAABCB1 | |
| SCHEMBL16998655 | 0.78 | RARB (0.49) | RARBRARARARGRXRAABCB1 | |
| SCHEMBL16998862 | 0.78 | RARB (0.55) | RARBRARARARGRXRAABCB1 | |
| SCHEMBL8514999 | 0.77 | CCNC (0.39) | — | |
| SCHEMBL8513591 | 0.75 | RARA (0.38) | RARBRARARARGRXRAABCB1 | |
| Hydrochloric Acid SCHEMBL8510905 | 0.74 | RARA (0.38) | RARBRARARARGRXRAABCB1 |
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 |