Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.36 |
| ▸ | RARB | P10826 | 3/20 | 0.33 |
| ▸ | RARA | P10276 | 2/20 | 0.33 |
| ▸ | F9 | P00740 | 2/20 | 0.33 |
| ▸ | RARG | P13631 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.33 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 1/20 | 0.31 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.31 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.30 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.30 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL363296 | 0.85 | GPBAR1 (0.38) | GPBAR1ADRB1ADRB3RARBRARA | |
| SCHEMBL362646 | 0.85 | GPBAR1 (0.38) | GPBAR1ADRB1ADRB3RARBRARA | |
| SCHEMBL363787 | 0.85 | GPBAR1 (0.38) | GPBAR1ADRB1ADRB3RARBRARA | |
| SCHEMBL1389726 | 0.79 | GPBAR1 (0.37) | GPBAR1ADRB1ADRB3RARBRARA | |
| SCHEMBL1389759 | 0.79 | GPBAR1 (0.37) | GPBAR1ADRB1ADRB3RARBRARA | |
| SCHEMBL1389965 | 0.79 | GPBAR1 (0.37) | GPBAR1ADRB1ADRB3RARBRARA | |
| SCHEMBL1389729 | 0.79 | GPBAR1 (0.37) | GPBAR1ADRB1ADRB3RARBRARA | |
| SCHEMBL1389761 | 0.79 | GPBAR1 (0.37) | GPBAR1ADRB1ADRB3RARBRARA | |
| SCHEMBL1389964 | 0.79 | GPBAR1 (0.37) | GPBAR1ADRB1ADRB3RARBRARA | |
| SCHEMBL1389961 | 0.79 | GPBAR1 (0.37) | GPBAR1ADRB1ADRB3RARBRARA |
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 |