Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DKK1 | O94907 | 3/20 | 0.56 |
| ▸ | RET | P07949 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | PAK4 | O96013 | 1/20 | 0.36 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.36 |
| ▸ | KARS1 | Q15046 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.35 |
| ▸ | SORD | Q00796 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8513412 | 0.99 | DKK1 (0.55) | DKK1RETKMOROCK2PAK4 | |
| SCHEMBL8515838 | 0.94 | DKK1 (0.49) | DKK1RETKMOROCK2DYRK1A | |
| SCHEMBL8510671 | 0.91 | DKK1 (0.44) | DKK1KMOPIK3CASORDMTOR | |
| SCHEMBL8511678 | 0.89 | DKK1 (0.58) | DKK1KMOROCK2PIK3CASORD | |
| SCHEMBL8514134 | 0.88 | DKK1 (0.42) | DKK1RETKMOPIK3CASORD | |
| SCHEMBL8510840 | 0.88 | KMO (0.43) | DKK1KMOPIK3CASORDMTOR | |
| SCHEMBL8514794 | 0.87 | DKK1 (0.41) | DKK1KMOPIK3CASORDMTOR | |
| Ammonia Solution, Strong SCHEMBL8587136 | 0.86 | DYRK1A (0.43) | DKK1KMODYRK1ASORD | |
| SCHEMBL8587138 | 0.86 | DKK1 (0.52) | DKK1KMOROCK2 | |
| SCHEMBL8511790 | 0.86 | ROCK2 (0.41) | DKK1KMOROCK2PIK3CA |
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 3 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 |
| WO-2012069852-A1 | PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF SPHINGOSINE KINASE | ALMAC DISCOVERY LIMITED (GB) | 2012-05-31 | — | — | WO | disclosed |