Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | RXRA | P19793 | 1/20 | 0.31 |
| ▸ | RXRB | P28702 | 1/20 | 0.31 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.30 |
| ▸ | MRGPRX4 | Q96LA9 | 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 | |
|---|---|---|---|---|
| SCHEMBL370503 | 0.85 | GPBAR1 (0.46) | GPBAR1RXRARXRBADRB3 | |
| SCHEMBL1390243 | 0.79 | GPBAR1 (0.47) | GPBAR1KDM4ERXRARXRBADRB3 | |
| SCHEMBL1390242 | 0.79 | GPBAR1 (0.47) | GPBAR1KDM4ERXRARXRBADRB3 | |
| SCHEMBL1390240 | 0.79 | GPBAR1 (0.47) | GPBAR1KDM4ERXRARXRBADRB3 | |
| SCHEMBL370694 | 0.76 | GPBAR1 (0.37) | GPBAR1KDM4E | |
| SCHEMBL362457 | 0.75 | GPBAR1 (0.48) | GPBAR1KDM4ERXRARXRB | |
| SCHEMBL1389996 | 0.71 | GPBAR1 (0.45) | GPBAR1KDM4ERXRARXRB | |
| SCHEMBL370196 | 0.71 | GPBAR1 (0.42) | GPBAR1 | |
| SCHEMBL1390000 | 0.71 | GPBAR1 (0.45) | GPBAR1KDM4ERXRARXRB | |
| SCHEMBL15949194 | 0.71 | GPBAR1 (0.38) | GPBAR1 |
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 |