Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 1/20 | 0.54 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.54 |
| ▸ | TACR1 | P25103 | 3/20 | 0.53 |
| ▸ | ACE | P12821 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | MBTPS1 | Q14703 | 1/20 | 0.51 |
| ▸ | TYR | P14679 | 1/20 | 0.50 |
| ▸ | CTSL | P07711 | 1/20 | 0.49 |
| ▸ | CTSB | P07858 | 1/20 | 0.49 |
| ▸ | CTSS | P25774 | 1/20 | 0.49 |
| ▸ | CTSK | P43235 | 1/20 | 0.49 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.48 |
| ▸ | LAP3 | P28838 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27604388 | 0.88 | ITGA4 (0.52) | ITGA4ITGB7TACR1ACEPOLB | |
| SCHEMBL20394533 | 0.87 | ITGA4 (0.60) | ITGA4ITGB7TACR1ACEPOLB | |
| SCHEMBL4169003 | 0.87 | ITGA4 (0.60) | ITGA4ITGB7TACR1ACEPOLB | |
| SCHEMBL20394525 | 0.86 | TACR1 (0.56) | ITGA4ITGB7TACR1ACEPOLB | |
| SCHEMBL20394526 | 0.86 | TACR1 (0.56) | ITGA4ITGB7TACR1ACEPOLB | |
| SCHEMBL15242283 | 0.86 | MMP8 (0.56) | TACR1POLBALDH1A1 | |
| SCHEMBL19647162 | 0.85 | ALDH1A1 (0.62) | POLBALDH1A1 | |
| SCHEMBL10420650 | 0.85 | TACR1 (0.57) | ITGA4ITGB7TACR1ACEPOLB | |
| SCHEMBL6898624 | 0.84 | ITGA4 (0.52) | ITGA4ITGB7TACR1ACEPOLB | |
| SCHEMBL27511974 | 0.84 | ITGA4 (0.52) | ITGA4ITGB7TACR1ACEPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-106566794-A | A genetically engineered bacterium producing 2-phenylethanol and an applying method thereof | 中国科学院微生物研究所 | 2017-04-19 | — | — | CN | disclosed |