Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 7/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | SLC6A1 | P30531 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1390235 | 1.00 | GPBAR1 (0.51) | GPBAR1NPC1RAB9AAPAF1BRD4 | |
| SCHEMBL1389850 | 1.00 | GPBAR1 (0.51) | GPBAR1NPC1RAB9AAPAF1BRD4 | |
| SCHEMBL1390613 | 1.00 | GPBAR1 (0.51) | GPBAR1NPC1RAB9AAPAF1BRD4 | |
| SCHEMBL370165 | 1.00 | GPBAR1 (0.51) | GPBAR1NPC1RAB9AAPAF1BRD4 | |
| SCHEMBL1390234 | 1.00 | GPBAR1 (0.51) | GPBAR1NPC1RAB9AAPAF1BRD4 | |
| SCHEMBL370166 | 1.00 | GPBAR1 (0.51) | GPBAR1NPC1RAB9AAPAF1BRD4 | |
| SCHEMBL1389856 | 1.00 | GPBAR1 (0.51) | GPBAR1NPC1RAB9AAPAF1BRD4 | |
| SCHEMBL1390568 | 1.00 | GPBAR1 (0.51) | GPBAR1NPC1RAB9AAPAF1BRD4 | |
| SCHEMBL1389852 | 1.00 | GPBAR1 (0.51) | GPBAR1NPC1RAB9AAPAF1BRD4 | |
| SCHEMBL1390567 | 1.00 | GPBAR1 (0.51) | GPBAR1NPC1RAB9AAPAF1BRD4 |
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 |