Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11081798 | 0.96 | MCL1 (0.41) | CREBBPHAO1MCL1ALDH1A1L3MBTL1 | |
| SCHEMBL11079196 | 0.94 | MCL1 (0.40) | HAO1MCL1ALDH1A1L3MBTL1MAPT | |
| SCHEMBL6294299 | 0.77 | MCL1 (0.38) | MCL1ALDH1A1L3MBTL1MAPTKDM4E | |
| SCHEMBL5049599 | 0.76 | PTGDR2 (0.42) | ALDH1A1CYP2C19HSD17B10 | |
| SCHEMBL3979460 | 0.76 | PTGDR2 (0.45) | MAPTKDM4EHSD17B10TSHR | |
| Hydrochloric Acid SCHEMBL5051903 | 0.75 | PTGDR2 (0.44) | MAPTKDM4EHSD17B10TSHR | |
| SCHEMBL5049361 | 0.75 | PTGDR2 (0.48) | MAPTKDM4E | |
| SCHEMBL5051928 | 0.75 | PTGDR2 (0.48) | MAPTKDM4E | |
| SCHEMBL3664492 | 0.74 | MCL1 (0.38) | HAO1MCL1ALDH1A1MAPTKDM4E | |
| SCHEMBL9699947 | 0.73 | MCL1 (0.44) | CREBBPMCL1ALDH1A1PARP1PARP2 |
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-4460600-A | Adjacently substituted ketal derivatives of cycloalkane-amide analgesics | THE UPJOHN COMPANY (US) | 1984-07-17 | — | — | US | disclosed |