Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDM2 | Q00987 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.36 |
| ▸ | GSK3B | P49841 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | PTGES | O14684 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 2/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | WNT1 | P04628 | 1/20 | 0.33 |
| ▸ | CTPS1 | P17812 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 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 | |
|---|---|---|---|---|
| SCHEMBL19365432 | 0.90 | MDM2 (0.39) | MDM2CNR2HCRTR2GSK3BMAPT | |
| SCHEMBL19670186 | 0.88 | CYP3A4 (0.37) | DYRK1AGRM5MTORWNT1HCRTR1 | |
| SCHEMBL19699070 | 0.85 | FGFR4 (0.41) | MDM2CNR2HCRTR2NPC1DYRK1A | |
| SCHEMBL19670597 | 0.84 | NPC1 (0.40) | NPC1GRM5PTGS1PTGS2DRD4 | |
| SCHEMBL19670357 | 0.83 | MPL (0.41) | CNR2GRM5FAAH | |
| SCHEMBL19865031 | 0.82 | CNR2 (0.46) | CNR2GSK3BNPC1DYRK1AGRM5 | |
| SCHEMBL17618761 | 0.82 | CNR2 (0.40) | MDM2CNR2HCRTR2GSK3BMAPT | |
| SCHEMBL19670187 | 0.82 | MTOR (0.36) | GSK3BMAPTNPC1DYRK1APTGS1 | |
| SCHEMBL17618539 | 0.81 | CNR2 (0.39) | MDM2CNR2HCRTR2GSK3BMAPT | |
| SCHEMBL19365285 | 0.80 | MTOR (0.35) | GSK3BMAPTPTGESGRM5FAAH |
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 |