Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | BUB1 | O43683 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 9/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL6165525 | 0.82 | HTT (0.61) | HTTHDAC1HDAC6OPRM1KMT2A | |
| SCHEMBL6166123 | 0.82 | ALPL (0.43) | HTTALPLHDAC1HDAC6BUB1 | |
| SCHEMBL6166935 | 0.80 | OPRM1 (0.39) | HTTALPLCRHBPCRHR2OPRM1 | |
| SCHEMBL6164113 | 0.78 | OPRM1 (0.49) | HTTALPLHDAC1HDAC6BUB1 | |
| SCHEMBL6164100 | 0.78 | HDAC1 (0.45) | HTTALPLHDAC1HDAC6BUB1 | |
| SCHEMBL6164656 | 0.78 | HTT (0.68) | HTTBUB1OPRM1 | |
| SCHEMBL6162828 | 0.77 | ALPL (0.63) | HTTALPLHDAC1HDAC6BUB1 | |
| SCHEMBL6165665 | 0.76 | ALPL (0.39) | HTTALPLHDAC1HDAC6BUB1 | |
| SCHEMBL6164263 | 0.76 | HTT (0.41) | HTTBUB1 | |
| SCHEMBL6163627 | 0.75 | HTT (0.40) | HTT |
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-1177185-B1 | 4, 5, 6, 7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA ITALIA SPA (IT) | 2005-04-20 | — | — | EP | disclosed |
| US-6716856-B1 | CELL PROLIFERATIVE DISORDERS OR ALZHEIMER'S DISEASE; REDUCED TOXICITY; CDK/CYCLIN KINASE INHIBITORY ACTIVITY | PHARMACIA & TUBJOHN SPA (IT) | 2004-04-06 | — | — | US | disclosed |