Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.52 |
| ▸ | CTSA | P10619 | 11/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL364123 | 1.00 | GPBAR1 (0.52) | GPBAR1CTSAMAP4K4PTGER4LDHA | |
| SCHEMBL1390361 | 0.91 | GPBAR1 (0.55) | GPBAR1CTSAMAP4K4LDHA | |
| SCHEMBL1390249 | 0.89 | GPBAR1 (0.63) | GPBAR1CTSAMAP4K4PTGER4 | |
| SCHEMBL361773 | 0.89 | GPBAR1 (0.63) | GPBAR1CTSAMAP4K4PTGER4 | |
| SCHEMBL371306 | 0.89 | GPBAR1 (0.63) | GPBAR1CTSAMAP4K4PTGER4 | |
| SCHEMBL1390097 | 0.87 | GPBAR1 (0.42) | GPBAR1CTSA | |
| SCHEMBL364911 | 0.85 | GPBAR1 (0.52) | GPBAR1CTSAMAP4K4PTGER4LDHA | |
| SCHEMBL362239 | 0.82 | GPBAR1 (0.66) | GPBAR1CTSAMAP4K4LDHA | |
| SCHEMBL362238 | 0.82 | GPBAR1 (0.66) | GPBAR1CTSAMAP4K4LDHA | |
| SCHEMBL1390075 | 0.82 | GPBAR1 (0.45) | GPBAR1CTSA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2593426-B1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | HOFFMANN LA ROCHE (CH) | 2014-08-20 | — | — | EP | disclosed |