Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 5/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | CTSA | P10619 | 5/20 | 0.35 |
| ▸ | CGAS | Q8N884 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.34 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL362542 | 1.00 | GPBAR1 (0.47) | GPBAR1BRD4CTSACGASSMN1; SMN2 | |
| SCHEMBL363734 | 0.91 | GPBAR1 (0.45) | GPBAR1BRD4CTSASMN1; SMN2TAS1R3 | |
| SCHEMBL363430 | 0.91 | GPBAR1 (0.45) | GPBAR1BRD4CTSASMN1; SMN2TAS1R3 | |
| SCHEMBL364728 | 0.89 | BRD4 (0.42) | GPBAR1BRD4CTSACGASSMN1; SMN2 | |
| SCHEMBL364032 | 0.87 | GPBAR1 (0.47) | GPBAR1BRD4SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL362902 | 0.86 | GPBAR1 (0.45) | GPBAR1BRD4ALDH1A1MEN1KMT2A | |
| SCHEMBL363678 | 0.86 | GPBAR1 (0.61) | GPBAR1BRD4CTSAALDH1A1MEN1 | |
| SCHEMBL364239 | 0.86 | GPBAR1 (0.47) | GPBAR1BRD4SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL363542 | 0.86 | GPBAR1 (0.47) | GPBAR1BRD4SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL362350 | 0.86 | GPBAR1 (0.48) | GPBAR1BRD4CTSASMN1; SMN2SLC6A9 |
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 |