Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.36 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | PTPRC | P08575 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7436296 | 1.00 | CYP2D6 (0.39) | CYP2D6CA12CA14KLK5CA2 | |
| SCHEMBL7437701 | 0.88 | CA12 (0.42) | CYP2D6CA12CA14KLK5CA2 | |
| SCHEMBL7438400 | 0.88 | CA12 (0.42) | CYP2D6CA12CA14KLK5CA2 | |
| SCHEMBL7437694 | 0.88 | CA12 (0.42) | CYP2D6CA12CA14KLK5CA2 | |
| SCHEMBL7432224 | 0.84 | PSENEN (0.43) | CA12CA14PSENENMAPTCTSS | |
| SCHEMBL7432219 | 0.84 | PSENEN (0.43) | CA12CA14PSENENMAPTCTSS | |
| SCHEMBL7431200 | 0.81 | CA14 (0.46) | CYP2D6CA12CA14CA2PTPRC | |
| SCHEMBL4095492 | 0.81 | CA14 (0.46) | CYP2D6CA12CA14CA2PTPRC | |
| SCHEMBL24072920 | 0.79 | GAA (0.43) | CA12CA14GAAMAPT | |
| SCHEMBL235261 | 0.78 | CYP2D6 (0.45) | CYP2D6CA12CA14CA2PTPRC |
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 |
|---|---|---|---|---|---|---|---|
| EP-0640594-A1 | Hydantoin derivative as metalloprotease inhibitor | FUJIREBIO INC. (JP) | 1995-03-01 | — | — | EP | disclosed |