Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | EPOR | P19235 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7333726 | 0.89 | ABCB1 (0.43) | ABCB1ITGB3ITGA2BCTSKCTSL | |
| SCHEMBL10436050 | 0.83 | CIT (0.41) | ABCB1ALDH1A1ALOX15LTA4H | |
| SCHEMBL9847303 | 0.82 | SIRT2 (0.31) | — | |
| SCHEMBL22457646 | 0.82 | ABCB1 (0.62) | ABCB1ITGB3ITGA2BCTSKCTSL | |
| SCHEMBL11639032 | 0.82 | CTRB1 (0.39) | ABCB1ITGB3ITGA2BALDH1A1CTRB1 | |
| SCHEMBL11267790 | 0.81 | ABCB1 (0.37) | ABCB1ALDH1A1TRPM8ALOX15CTRB1 | |
| SCHEMBL29897717 | 0.80 | CTRB1 (0.38) | ABCB1ITGB3ITGA2BALDH1A1CTRB1 | |
| SCHEMBL7327907 | 0.80 | MMP13 (0.36) | ALDH1A1MAPTRECQL | |
| SCHEMBL6371254 | 0.79 | EPOR (0.35) | ALDH1A1TRPM8ALOX15CTRB1MAPT | |
| SCHEMBL29401219 | 0.79 | ALDH1A1 (0.54) | CTSKCTSLCTSBCTSSALDH1A1 |
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-0396065-A1 | Novel amino acid derivatives possessing renin-inhibitory activities | Japan Tobacco Inc. (JP) | 1990-11-07 | — | — | EP | disclosed |