Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 5/20 | 0.43 |
| ▸ | CTSA | P10619 | 6/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.34 |
| ▸ | PAK4 | O96013 | 3/20 | 0.34 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 2/20 | 0.32 |
| ▸ | MMP9 | P14780 | 2/20 | 0.32 |
| ▸ | MMP12 | P39900 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL371107 | 0.85 | GPBAR1 (0.42) | GPBAR1CTSAHSD17B2SLC6A9 | |
| SCHEMBL15949284 | 0.84 | GPBAR1 (0.60) | GPBAR1CTSAHSD17B2 | |
| SCHEMBL370207 | 0.83 | GPBAR1 (0.42) | GPBAR1SLC6A9 | |
| SCHEMBL369130 | 0.79 | GPBAR1 (0.49) | GPBAR1CTSASLC6A9 | |
| SCHEMBL1389778 | 0.79 | GPBAR1 (0.49) | GPBAR1CTSASLC6A9 | |
| SCHEMBL1389775 | 0.79 | GPBAR1 (0.49) | GPBAR1CTSASLC6A9 | |
| SCHEMBL369898 | 0.75 | GPBAR1 (0.42) | GPBAR1CTSASLC6A9MMP2MMP9 | |
| SCHEMBL361767 | 0.73 | GPBAR1 (0.47) | GPBAR1CTSASLC6A9 | |
| SCHEMBL362542 | 0.73 | GPBAR1 (0.47) | GPBAR1CTSASLC6A9 | |
| SCHEMBL15949003 | 0.72 | GPBAR1 (0.48) | GPBAR1 |
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-2593426-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012007365-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | disclosed |