Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARA | P10276 | 2/20 | 0.45 |
| ▸ | RARB | P10826 | 2/20 | 0.45 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.40 |
| ▸ | CNR1 | P21554 | 7/20 | 0.38 |
| ▸ | RARG | P13631 | 2/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.36 |
| ▸ | SMO | Q99835 | 1/20 | 0.36 |
| ▸ | KARS1 | Q15046 | 2/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8612509 | 0.99 | RARA (0.44) | RARARARBCCNT1CNR1RARG | |
| SCHEMBL12632945 | 0.84 | RARB (0.56) | RARARARBCCNT1CNR1RARG | |
| SCHEMBL8510951 | 0.83 | DKK1 (0.45) | RARARARBSMO | |
| SCHEMBL12633193 | 0.83 | RARA (0.45) | RARARARBCCNT1CNR1RARG | |
| SCHEMBL8515149 | 0.83 | RARA (0.49) | RARARARBPIM1PIM3PIM2 | |
| SCHEMBL12633266 | 0.82 | RARB (0.45) | RARARARBCCNT1CNR1RARG | |
| Hydrochloric Acid SCHEMBL8512387 | 0.82 | DKK1 (0.44) | RARARARBSMO | |
| SCHEMBL12632966 | 0.82 | RARB (0.45) | RARARARBCCNT1CNR1RARG | |
| Hydrochloric Acid SCHEMBL8515557 | 0.82 | RARA (0.48) | RARARARBPIM1PIM3PIM2 | |
| Hydrochloric Acid SCHEMBL2015173 | 0.82 | RARA (0.48) | RARARARBPIM1PIM3PIM2 |
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 2 patents. 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 |
| WO-2012069852-A1 | PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF SPHINGOSINE KINASE | ALMAC DISCOVERY LIMITED (GB) | 2012-05-31 | — | — | WO | disclosed |