Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SYK | P43405 | 4/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.38 |
| ▸ | WNT1 | P04628 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | RARA | P10276 | 4/20 | 0.37 |
| ▸ | RARB | P10826 | 4/20 | 0.37 |
| ▸ | RARG | P13631 | 3/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL8511882 | 0.91 | RARB (0.39) | SYKROCK1PRMT5DYRK1AWNT1 | |
| SCHEMBL8510708 | 0.81 | RARB (0.42) | RARARARBRARG | |
| SCHEMBL8510098 | 0.81 | IRAK4 (0.36) | SYKIRAK4 | |
| SCHEMBL8511070 | 0.81 | IRAK4 (0.48) | SYKROCK1DYRK1ARARARARB | |
| SCHEMBL8515571 | 0.74 | CYP1A2 (0.47) | DYRK1ACYP1A2RARARARBRARG | |
| Trifluoroacetic Acid SCHEMBL8514001 | 0.73 | RARA (0.42) | RARARARBRARGHRH3IRAK4 | |
| Hydrochloric Acid SCHEMBL8514610 | 0.73 | CYP1A2 (0.46) | DYRK1ACYP1A2RARARARBRARG | |
| Trifluoroacetic Acid SCHEMBL8514057 | 0.72 | RARB (0.39) | DYRK1ARARARARBRARGPIM1 | |
| SCHEMBL15360212 | 0.69 | SYK (0.58) | SYKROCK1PRMT5IKBKBIRAK4 | |
| SCHEMBL2223890 | 0.69 | NR1H4 (0.61) | CYP1A2RARARARBRARG |
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 |