Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | CCKBR | P32239 | 2/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9493769 | 0.92 | PDCD1 (0.37) | PDCD1CD274SIGMAR1CYP3A4CYP2C19 | |
| SCHEMBL9494267 | 0.92 | PDCD1 (0.36) | PDCD1CD274SCN9ASIGMAR1CYP3A4 | |
| SCHEMBL9493013 | 0.92 | PDCD1 (0.37) | PDCD1CD274SCN9AMDM2SIGMAR1 | |
| SCHEMBL9493643 | 0.91 | PDCD1 (0.35) | PDCD1CD274MDM2SIGMAR1CYP3A4 | |
| SCHEMBL7318601 | 0.91 | TPSAB1 (0.36) | PDCD1CD274SCN9AITGB3ITGA2B | |
| SCHEMBL7326332 | 0.89 | ITGB3 (0.34) | SCN9AITGB3ITGA2BF2F10 | |
| SCHEMBL7333235 | 0.85 | SCN9A (0.38) | SCN9AITGB3ITGA2BF2F10 | |
| SCHEMBL9262540 | 0.85 | SCN9A (0.34) | PDCD1CD274SCN9AITGB3ITGA2B | |
| SCHEMBL9492960 | 0.84 | PDCD1 (0.38) | PDCD1CD274SIGMAR1SLC6A9CYP3A4 | |
| SCHEMBL7324643 | 0.83 | PDCD1 (0.36) | PDCD1CD274SIGMAR1 |
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-5250679-A | Nonpeptidyl platelet aggregation inhibitors having specificity for the GPIIb III.sub. receptor | GENENTECH, INC. (US) | 1993-10-05 | — | — | US | disclosed |