Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 7/20 | 0.37 |
| ▸ | KDR | P35968 | 2/20 | 0.36 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | FLT1 | P17948 | 1/20 | 0.33 |
| ▸ | FABP1 | P07148 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL363688 | 0.91 | GPBAR1 (0.38) | GPBAR1MRGPRX4POLB | |
| SCHEMBL369888 | 0.89 | KDR (0.38) | GPBAR1AKR1C3PPARGKDRMRGPRX4 | |
| SCHEMBL362892 | 0.86 | GPBAR1 (0.39) | GPBAR1 | |
| SCHEMBL361842 | 0.84 | GPBAR1 (0.51) | GPBAR1 | |
| SCHEMBL1390092 | 0.83 | GPBAR1 (0.40) | GPBAR1AKR1C3PPARGMRGPRX4 | |
| SCHEMBL1390090 | 0.83 | GPBAR1 (0.40) | GPBAR1AKR1C3PPARGMRGPRX4 | |
| SCHEMBL363245 | 0.81 | GPBAR1 (0.43) | GPBAR1 | |
| SCHEMBL365756 | 0.81 | ADRB3 (0.38) | GPBAR1AKR1C3PPARGMRGPRX4NPC1 | |
| SCHEMBL363831 | 0.80 | GPBAR1 (0.42) | GPBAR1PPARGCYP2C9 | |
| SCHEMBL363394 | 0.79 | MRGPRX4 (0.40) | GPBAR1PPARGKDRMRGPRX4 |
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 |