Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.31 |
| ▸ | CPA1 | P15085 | 1/20 | 0.30 |
| ▸ | ALPG | P10696 | 1/20 | 0.30 |
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 SCHEMBL2072798 | 1.00 | CES1 (0.35) | CES1POLBHSD17B10KDM1AALOX5 | |
| SCHEMBL224635 | 0.82 | ALOX5 (0.41) | ALOX5 | |
| Hydrochloric Acid SCHEMBL7159864 | 0.80 | ALOX5 (0.39) | ALOX5 | |
| Hydrochloric Acid SCHEMBL6760431 | 0.80 | ALOX5 (0.39) | ALOX5 | |
| Biphenyl SCHEMBL12979723 | 0.79 | ALDH1A1 (0.36) | POLBALOX5 | |
| SCHEMBL18209132 | 0.78 | ALOX5 (0.34) | ALOX5 | |
| SCHEMBL7441406 | 0.72 | ALOX5 (0.35) | ALOX5 | |
| SCHEMBL1938607 | 0.71 | ALOX5 (0.32) | ALOX5 | |
| Trifluoroacetic Acid SCHEMBL5465747 | 0.68 | CES1 (0.39) | CES1HSD17B10KDM1ACPA1 | |
| SCHEMBL6207088 | 0.67 | ALOX5 (0.47) | POLBHSD17B10ALOX5L3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7863294-B2 | Heterocycle derivatives as histone deacetylase (HDAC) inhibitors | INSTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2011-01-04 | — | — | US | disclosed |