Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.56 |
| ▸ | CA1 | P00915 | 3/20 | 0.56 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.54 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.54 |
| ▸ | PLK1 | P53350 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 2/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 1/20 | 0.48 |
| ▸ | GART | P22102 | 4/20 | 0.48 |
| ▸ | FOLR2 | P14207 | 1/20 | 0.48 |
| ▸ | FOLR1 | P15328 | 1/20 | 0.48 |
| ▸ | SLC19A1 | P41440 | 1/20 | 0.48 |
| ▸ | SLC46A1 | Q96NT5 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ATIC | P31939 | 1/20 | 0.45 |
| ▸ | SHMT1 | P34896 | 1/20 | 0.45 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2246124 | 0.95 | CA2 (0.56) | CA2CA1TAS1R3TAS1R1PPARG | |
| SCHEMBL2246916 | 0.91 | CA2 (0.58) | CA2CA1TAS1R3TAS1R1PLK1 | |
| SCHEMBL2244785 | 0.86 | CA12 (0.56) | CA1TAS1R3TAS1R1PLK1PPARG | |
| SCHEMBL2251677 | 0.83 | GPR132 (0.55) | CA2CA1 | |
| SCHEMBL2246061 | 0.83 | CA2 (0.69) | CA2CA1NPC1RAB9A | |
| SCHEMBL2245325 | 0.83 | CA2 (0.69) | CA2CA1NPC1RAB9A | |
| SCHEMBL2249692 | 0.82 | CA2 (0.62) | CA2CA1TAS1R3TAS1R1NPC1 | |
| SCHEMBL2246121 | 0.82 | CA12 (0.56) | CA1TAS1R3TAS1R1PPARGHRH3 | |
| SCHEMBL2246549 | 0.81 | RXRA (0.58) | CA2CA1 | |
| SCHEMBL2243990 | 0.81 | DHFR (0.50) | CA2CA1 |
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-7998965-B2 | Glutamate aggrecanase inhibitors | WYETH LLC (US) | 2011-08-16 | — | — | US | disclosed |