Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | PTPRB | P23467 | 1/20 | 0.32 |
| ▸ | NOS3 | P29474 | 2/20 | 0.32 |
| ▸ | NOS1 | P29475 | 2/20 | 0.32 |
| ▸ | NOS2 | P35228 | 2/20 | 0.32 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | F2 | P00734 | 1/20 | 0.31 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.31 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.31 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.31 |
| ▸ | CASR | P41180 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15776161 | 0.79 | KDM4E (0.40) | KDM4EPOLBTSHRTACR1CA1 | |
| SCHEMBL15776350 | 0.79 | KDM4E (0.40) | KDM4EPOLBTSHRTACR1CA1 | |
| SCHEMBL19225503 | 0.70 | TSHR (0.40) | KDM4EPOLBTSHRTACR1CA1 | |
| SCHEMBL4040412 | 0.67 | KDM4E (0.54) | KDM4EPOLBTSHRTACR1CA1 | |
| SCHEMBL13557891 | 0.66 | KDM4E (0.56) | KDM4EPOLBTSHRTACR1CA1 | |
| SCHEMBL6531372 | 0.66 | KDM4E (0.61) | KDM4EPOLBTSHRTACR1CA1 | |
| SCHEMBL95926 | 0.66 | KDM4E (0.56) | KDM4EPOLBTSHRTACR1CA1 | |
| SCHEMBL29108931 | 0.66 | KDM4E (0.61) | KDM4EPOLBTSHRTACR1CA1 | |
| SCHEMBL1691827 | 0.66 | TSHR (0.61) | KDM4EPOLBTSHRTACR1CA1 | |
| SCHEMBL28114670 | 0.65 | KDM4E (0.51) | KDM4EPOLBTSHRTACR1PTPRB |
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-2928867-B1 | PYRIDINE-2-AMIDES USEFUL AS CB2 AGONISTS | HOFFMANN LA ROCHE (CH) | 2017-08-09 | — | — | EP | disclosed |