Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCEH1 | Q6PIU2 | 2/20 | 0.41 |
| ▸ | FAAH | O00519 | 3/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | GNRHR | P30968 | 2/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5040330 | 0.89 | NTMT1 (0.40) | NCEH1FAAHCNR1CNR2PLA2G4A | |
| SCHEMBL5044496 | 0.88 | ATP4A (0.37) | CTSKLMNAALOX5 | |
| SCHEMBL5047187 | 0.88 | HDAC3 (0.36) | CTSKALDH1A1HSD17B10 | |
| SCHEMBL5047889 | 0.87 | MGLL (0.36) | CTSKLMNAALOX5HTR2AHTR2C | |
| SCHEMBL5044961 | 0.87 | HTR2A (0.46) | CNR1PIK3CDPIK3CAGNRHRLMNA | |
| SCHEMBL5047174 | 0.87 | CNR1 (0.40) | CNR1CNR2HTR2AHTR2CSLC6A4 | |
| SCHEMBL5044102 | 0.86 | MAPT (0.40) | CNR1HTR2AHTR2CSLC6A4ALDH1A1 | |
| SCHEMBL5048696 | 0.86 | CDC25A (0.43) | FAAHLMNAALDH1A1 | |
| SCHEMBL5047653 | 0.85 | ATP4A (0.38) | — | |
| SCHEMBL5040295 | 0.84 | DNM1L (0.36) | FAAHCTSKALDH1A1HSD17B10 |
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-1583762-B1 | PYRROLYL-THIAZOLES AND THEIR USE AS CB 1 RECEPTOR INVERSE AGONISTS | HOFFMANN LA ROCHE (CH) | 2008-07-09 | — | — | EP | claimed |