Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.44 |
| ▸ | CYSLTR1 | Q9Y271 | 7/20 | 0.44 |
| ▸ | CYSLTR2 | Q9NS75 | 4/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8543204 | 0.77 | FFAR1 (0.57) | GPBAR1AKR1B1MCL1CYSLTR1CYSLTR2 | |
| SCHEMBL10436587 | 0.74 | GPBAR1 (0.53) | GPBAR1AKR1B1CYSLTR1CYSLTR2FFAR1 | |
| SCHEMBL9680639 | 0.72 | CDC25A (0.53) | MCL1 | |
| SCHEMBL7593150 | 0.72 | GPBAR1 (0.56) | GPBAR1AKR1B1CYSLTR1CYSLTR2FFAR1 | |
| SCHEMBL140815 | 0.71 | CYP1A2 (0.65) | GPBAR1AKR1B1CYSLTR1CYSLTR2FFAR1 | |
| SCHEMBL8595609 | 0.71 | CYSLTR1 (0.50) | GPBAR1CYSLTR1CYSLTR2CYP1A2PDE10A | |
| SCHEMBL6089876 | 0.70 | GPBAR1 (0.68) | GPBAR1AKR1B1CYSLTR1CYSLTR2FFAR1 | |
| SCHEMBL9140671 | 0.70 | LTB4R (0.57) | AKR1B1MCL1CYSLTR1CYSLTR2FFAR1 | |
| SCHEMBL11883719 | 0.69 | MCL1 (0.46) | MCL1 | |
| SCHEMBL8541189 | 0.69 | AKR1B1 (0.57) | GPBAR1AKR1B1CYSLTR1CYSLTR2FFAR1 |
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-6376528-B1 | SYNERGISTIC MIXTURE | G. D. SEARLE & CO. | 2002-04-23 | — | — | US | disclosed |