Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.31 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.31 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.31 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.31 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | PHGDH | O43175 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.31 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.31 |
| ▸ | PLA2G4A | P47712 | 2/20 | 0.31 |
| ▸ | RXRA | P19793 | 2/20 | 0.31 |
| ▸ | RXRB | P28702 | 1/20 | 0.31 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL370694 | 0.90 | GPBAR1 (0.37) | GPBAR1PPARGKEAP1NFE2L2MEN1 | |
| SCHEMBL370210 | 0.85 | GPBAR1 (0.43) | GPBAR1ADRB3RXRARXRB | |
| SCHEMBL369177 | 0.84 | GPBAR1 (0.33) | GPBAR1KEAP1NFE2L2 | |
| SCHEMBL369976 | 0.83 | GPBAR1 (0.35) | GPBAR1 | |
| SCHEMBL369931 | 0.79 | GPBAR1 (0.51) | GPBAR1PPARGKEAP1NFE2L2SRD5A2 | |
| SCHEMBL1390130 | 0.79 | GPBAR1 (0.51) | GPBAR1PPARGKEAP1NFE2L2SRD5A2 | |
| SCHEMBL10241339 | 0.79 | GPBAR1 (0.51) | GPBAR1PPARGKEAP1NFE2L2SRD5A2 | |
| SCHEMBL369930 | 0.79 | GPBAR1 (0.51) | GPBAR1PPARGKEAP1NFE2L2SRD5A2 | |
| SCHEMBL10241335 | 0.79 | GPBAR1 (0.51) | GPBAR1PPARGKEAP1NFE2L2SRD5A2 | |
| SCHEMBL370370 | 0.78 | FFAR1 (0.33) | PTGER4PTGER2 |
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 |