Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | SORD | Q00796 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 2/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | DKK1 | O94907 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8536754 | 0.91 | DKK1 (0.40) | ACHEKMOCTSSCTSKSORD | |
| SCHEMBL9612650 | 0.89 | CARM1 (0.41) | KMOCTSSCTSKSORDDKK1 | |
| SCHEMBL8515288 | 0.85 | CARM1 (0.39) | KMOCTSSCTSKDKK1 | |
| SCHEMBL8510840 | 0.85 | KMO (0.43) | LRRK2KMOSORDALDH1A1HPGD | |
| SCHEMBL8515556 | 0.85 | MEN1 (0.40) | LRRK2KMOCTSSCTSKSORD | |
| SCHEMBL8510671 | 0.84 | DKK1 (0.44) | LRRK2KMOSORDMTORPIK3CA | |
| SCHEMBL9612861 | 0.84 | S1PR1 (0.41) | KMOSORDMTORPIK3CADKK1 | |
| SCHEMBL8511790 | 0.83 | ROCK2 (0.41) | ACHELRRK2KMOALDH1A1PIK3CA | |
| SCHEMBL8514120 | 0.83 | KMO (0.40) | KMOSORDALDH1A1HPGDMTOR | |
| Hydrochloric Acid SCHEMBL8512525 | 0.82 | ROCK2 (0.41) | ACHELRRK2KMOALDH1A1DKK1 |
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 | disclosed |
| WO-2012069852-A1 | PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF SPHINGOSINE KINASE | ALMAC DISCOVERY LIMITED (GB) | 2012-05-31 | — | — | WO | disclosed |