Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | FGFR4 | P22455 | 3/20 | 0.36 |
| ▸ | KMO | O15229 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL19365508 | 0.88 | FGFR4 (0.42) | CA2CA9FGFR4KMOCNR2 | |
| SCHEMBL20632032 | 0.86 | SCN9A (0.40) | ADORA2ACA2CA9KMOCNR1 | |
| SCHEMBL19705998 | 0.84 | TRPA1 (0.38) | ADORA2ACA2CA9TRPV3KMO | |
| SCHEMBL19670654 | 0.83 | CA2 (0.42) | ADORA2ACA2CA9CNR1CNR2 | |
| SCHEMBL19365868 | 0.82 | GPR52 (0.38) | CA2CA9TRPV3FGFR4KMO | |
| SCHEMBL19365537 | 0.82 | CA2 (0.43) | CA2CA9KDM1ACNR2KDM4E | |
| SCHEMBL12654397 | 0.82 | FAAH (0.41) | ADORA2ACA2CA9KMOCNR1 | |
| SCHEMBL19365266 | 0.81 | GRIN2B (0.38) | CA2CA9FYNNPC1SMN1; SMN2 | |
| SCHEMBL12959008 | 0.81 | PHGDH (0.49) | ADORA2AKMO | |
| SCHEMBL19669976 | 0.81 | HTR2A (0.52) | CA2CA9CNR1FYNL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2997029-B1 | SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2019-01-09 | — | — | EP | disclosed |