Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 7/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | RORC | P51449 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | CTSA | P10619 | 1/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.35 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.35 |
| ▸ | ITGAL | P20701 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1390028 | 1.00 | GPBAR1 (0.63) | GPBAR1TDP1RORCALDH1A1NPSR1 | |
| SCHEMBL368846 | 1.00 | GPBAR1 (0.63) | GPBAR1TDP1RORCALDH1A1NPSR1 | |
| SCHEMBL368847 | 1.00 | GPBAR1 (0.63) | GPBAR1TDP1RORCALDH1A1NPSR1 | |
| SCHEMBL1390030 | 1.00 | GPBAR1 (0.63) | GPBAR1TDP1RORCALDH1A1NPSR1 | |
| SCHEMBL364189 | 0.93 | GPBAR1 (0.65) | GPBAR1NPSR1CTSANR3C2CYP2C19 | |
| SCHEMBL1389955 | 0.93 | GPBAR1 (0.65) | GPBAR1NPSR1CTSANR3C2CYP2C19 | |
| SCHEMBL362777 | 0.93 | GPBAR1 (0.65) | GPBAR1NPSR1CTSANR3C2CYP2C19 | |
| SCHEMBL1389953 | 0.93 | GPBAR1 (0.65) | GPBAR1NPSR1CTSANR3C2CYP2C19 | |
| SCHEMBL1389739 | 0.93 | GPBAR1 (0.65) | GPBAR1NPSR1CTSANR3C2CYP2C19 | |
| SCHEMBL1389958 | 0.93 | GPBAR1 (0.65) | GPBAR1NPSR1CTSANR3C2CYP2C19 |
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 |