Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.42 |
| ▸ | CTSA | P10619 | 8/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 3/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | BRS3 | P32247 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL363245 | 0.91 | GPBAR1 (0.43) | GPBAR1CTSABRD4 | |
| SCHEMBL361842 | 0.89 | GPBAR1 (0.51) | GPBAR1CTSABRD4 | |
| SCHEMBL363216 | 0.85 | GPBAR1 (0.39) | GPBAR1CTSABRD4 | |
| SCHEMBL363688 | 0.84 | GPBAR1 (0.38) | GPBAR1CTSABRD4 | |
| SCHEMBL362317 | 0.84 | GPBAR1 (0.52) | GPBAR1CTSADHODHBRD4 | |
| SCHEMBL1390089 | 0.83 | GPBAR1 (0.43) | GPBAR1CTSALTB4R2PPARGNR1I2 | |
| SCHEMBL1390087 | 0.83 | GPBAR1 (0.43) | GPBAR1CTSALTB4R2PPARGNR1I2 | |
| SCHEMBL15949190 | 0.82 | GPBAR1 (0.39) | GPBAR1CTSADHODHLTB4R2PPARG | |
| SCHEMBL362892 | 0.80 | GPBAR1 (0.39) | GPBAR1CTSAMCL1 | |
| SCHEMBL363623 | 0.80 | GPBAR1 (0.39) | GPBAR1PPARGCYP2C9 |
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 4 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 | claimed |
| WO-2012007365-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | claimed |
| 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 |