Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | IDH2 | P48735 | 6/20 | 0.35 |
| ▸ | CTSC | P53634 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 4/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | LPL | P06858 | 1/20 | 0.33 |
| ▸ | LIPC | P11150 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19670330 | 0.87 | IDH2 (0.36) | IDH2CNR2CNR1LPLLIPC | |
| SCHEMBL19670568 | 0.86 | IDH2 (0.38) | IDH2CNR2CNR1 | |
| SCHEMBL19670210 | 0.86 | CNR2 (0.36) | IDH2PIM1CNR2CNR1 | |
| SCHEMBL19670570 | 0.85 | IDH2 (0.36) | IDH2CNR2CNR1 | |
| SCHEMBL19670197 | 0.84 | CNR2 (0.35) | IDH2GAANPSR1CNR2CNR1 | |
| SCHEMBL19670566 | 0.83 | IDH2 (0.35) | IDH2CNR2CNR1 | |
| SCHEMBL17618369 | 0.81 | IDH2 (0.39) | SCN9AIDH2HCRTR1HCRTR2PIM1 | |
| SCHEMBL17618500 | 0.78 | LPL (0.41) | SCN9AIDH2CYP2C9CYP2C19CA2 | |
| SCHEMBL17618380 | 0.78 | LPL (0.41) | SCN9AIDH2CYP2C9CYP2C19CA2 | |
| SCHEMBL16249970 | 0.72 | IDH2 (0.40) | IDH2PIM1KCNH2CYP1A2CYP3A4 |
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-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |