Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 2/20 | 0.35 |
| ▸ | CTSK | P43235 | 4/20 | 0.33 |
| ▸ | CTSS | P25774 | 3/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1508734 | 0.80 | CYP2D6 (0.42) | CYP2D6CA2CA1CA7PTPRC | |
| SCHEMBL235261 | 0.79 | CYP2D6 (0.45) | CYP2D6CA2CA1CA7PTPRC | |
| SCHEMBL24269352 | 0.77 | CYP2D6 (0.44) | CYP2D6CA2CA1CA7PTPRC | |
| SCHEMBL2407746 | 0.76 | CYP2D6 (0.39) | CYP2D6CA2CA1CA7PTPRC | |
| SCHEMBL2317242 | 0.76 | CYP2D6 (0.39) | CYP2D6CA2CA1CA7PTPRC | |
| SCHEMBL1339541 | 0.76 | CYP2D6 (0.39) | CYP2D6CA2CA1CA7PTPRC | |
| SCHEMBL4095492 | 0.74 | CA14 (0.46) | CYP2D6CA2CA1CA7PTPRC | |
| SCHEMBL7431200 | 0.74 | CA14 (0.46) | CYP2D6CA2CA1CA7PTPRC | |
| SCHEMBL18362416 | 0.73 | CYP2D6 (0.37) | CYP2D6CA2CA1CA7PTPRC | |
| SCHEMBL3958728 | 0.73 | CTSK (0.42) | CYP2D6CA2CA1CA7PTPRC |
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 |
|---|---|---|---|---|---|---|---|
| US-5726185-A | BINDING OF ADHESIVE PROTEINS TO BLOOD PLATELET AGGREGATION AND CELL TO CELL ADHESION | HOFFMANN-LA ROCHE INC. (US) | 1998-03-10 | — | — | US | disclosed |