Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 4/20 | 0.51 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | AHR | P35869 | 3/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | CMA1 | P23946 | 2/20 | 0.44 |
| ▸ | TDP2 | O95551 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CDC25A | P30304 | 1/20 | 0.39 |
| ▸ | CDC25B | P30305 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4874161 | 0.86 | SMYD3 (0.51) | SMYD3CRBNGAAAHRHSD11B1 | |
| SCHEMBL3573876 | 0.84 | SMYD3 (0.56) | SMYD3CRBNAHRHSD11B1PDK2 | |
| SCHEMBL3194345 | 0.84 | SMYD3 (0.58) | SMYD3CRBNAHRHSD11B1PDK2 | |
| SCHEMBL30760741 | 0.84 | SMYD3 (0.58) | SMYD3CRBNAHRHSD11B1PDK2 | |
| SCHEMBL3581639 | 0.83 | TDP2 (0.55) | SMYD3CRBNAHRHSD11B1PDK2 | |
| Hydrochloric Acid SCHEMBL29528151 | 0.82 | SMYD3 (0.57) | SMYD3CRBNAHRHSD11B1PDK2 | |
| SCHEMBL7679044 | 0.81 | SMYD3 (0.53) | SMYD3CRBNGAAAHRHSD11B1 | |
| SCHEMBL3573881 | 0.77 | SMYD3 (0.55) | SMYD3CRBNAHRHSD11B1PDK2 | |
| SCHEMBL3578248 | 0.77 | SMYD3 (0.52) | SMYD3CRBNAHRHSD11B1PDK2 | |
| SCHEMBL398818 | 0.75 | TDP2 (0.66) | SMYD3CRBNGAAAHRHSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1902025-A1 | KINASE INHIBITORS | Allergan, Inc. (US) | 2008-03-26 | — | — | EP | disclosed |
| WO-2007008895-A1 | KINASE INHIBITORS | ALLERGAN, INC. (US) | 2007-01-18 | — | — | WO | disclosed |