Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 4/20 | 0.51 |
| ▸ | FFAR1 | O14842 | 10/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 4/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | FPR1 | P21462 | 1/20 | 0.34 |
| ▸ | FPR3 | P25089 | 1/20 | 0.34 |
| ▸ | GPR183 | P32249 | 1/20 | 0.34 |
| ▸ | APLNR | P35414 | 1/20 | 0.34 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | RXRG | P48443 | 1/20 | 0.34 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | MMEL1 | Q495T6 | 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 | |
|---|---|---|---|---|
| SCHEMBL362545 | 0.88 | GPBAR1 (0.66) | GPBAR1BRD4RXRARXRBRXRG | |
| SCHEMBL364092 | 0.88 | GPBAR1 (0.48) | GPBAR1FFAR1BRD4CTSALMNA | |
| SCHEMBL363349 | 0.88 | GPBAR1 (0.66) | GPBAR1BRD4RXRARXRBRXRG | |
| SCHEMBL364601 | 0.88 | GPBAR1 (0.66) | GPBAR1BRD4RXRARXRBRXRG | |
| SCHEMBL363650 | 0.85 | GPBAR1 (0.58) | GPBAR1BRD4RXRARXRBRXRG | |
| SCHEMBL363678 | 0.85 | GPBAR1 (0.61) | GPBAR1BRD4CTSA | |
| SCHEMBL362317 | 0.84 | GPBAR1 (0.52) | GPBAR1FFAR1BRD4S1PR1CTSA | |
| SCHEMBL364071 | 0.83 | GPBAR1 (0.47) | GPBAR1BRD4 | |
| SCHEMBL363585 | 0.82 | GPBAR1 (0.45) | GPBAR1BRD4 | |
| SCHEMBL362350 | 0.81 | GPBAR1 (0.48) | GPBAR1BRD4CTSA |
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 |