Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 6/20 | 0.55 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 3/20 | 0.34 |
| ▸ | HNF4A | P41235 | 1/20 | 0.34 |
| ▸ | MGAM | O43451 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | SI | P14410 | 2/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.32 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.32 |
| ▸ | RXRB | P28702 | 2/20 | 0.32 |
| ▸ | RXRG | P48443 | 1/20 | 0.32 |
| ▸ | CTSA | P10619 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL362545 | 0.92 | GPBAR1 (0.66) | GPBAR1BRD4RXRAMGAMGAA | |
| SCHEMBL364601 | 0.92 | GPBAR1 (0.66) | GPBAR1BRD4RXRAMGAMGAA | |
| SCHEMBL363349 | 0.92 | GPBAR1 (0.66) | GPBAR1BRD4RXRAMGAMGAA | |
| SCHEMBL362457 | 0.90 | GPBAR1 (0.48) | GPBAR1BRD4RXRAMGAMGAA | |
| SCHEMBL362281 | 0.90 | GPBAR1 (0.48) | GPBAR1BRD4RXRAHNF4ARXRB | |
| SCHEMBL362527 | 0.89 | GPBAR1 (0.55) | GPBAR1BRD4RXRAMGAMGAA | |
| SCHEMBL363678 | 0.88 | GPBAR1 (0.61) | GPBAR1BRD4TTRMGAMGAA | |
| SCHEMBL361680 | 0.88 | GPBAR1 (0.47) | GPBAR1BRD4RXRAMGAMGAA | |
| SCHEMBL361842 | 0.87 | GPBAR1 (0.51) | GPBAR1BRD4TTRRXRARXRB | |
| SCHEMBL363235 | 0.87 | GPBAR1 (0.51) | GPBAR1BRD4RXRAHNF4ARXRB |
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 |