Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 7/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 4/20 | 0.44 |
| ▸ | HTR2C | P28335 | 3/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20002731 | 0.84 | L3MBTL1 (0.48) | RORCL3MBTL1HTR2AHTR2CKCNH2 | |
| SCHEMBL20002251 | 0.84 | RORC (0.52) | RORCL3MBTL1NR1I2CCR5ALDH1A1 | |
| SCHEMBL20002254 | 0.84 | L3MBTL1 (0.48) | RORCL3MBTL1HTR2AHTR2CKCNH2 | |
| SCHEMBL20002434 | 0.84 | L3MBTL1 (0.56) | RORCL3MBTL1NR1I2EPHX2ALDH1A1 | |
| SCHEMBL20002381 | 0.84 | L3MBTL1 (0.56) | RORCL3MBTL1NR1I2EPHX2ALDH1A1 | |
| SCHEMBL20002691 | 0.84 | L3MBTL1 (0.43) | RORCL3MBTL1HTR2AHTR2CKCNH2 | |
| SCHEMBL20002855 | 0.83 | MAPT (0.47) | RORCL3MBTL1HTR2AHTR2CKCNH2 | |
| SCHEMBL20002498 | 0.83 | RORC (0.49) | RORCL3MBTL1HTR2AHTR2CKCNH2 | |
| SCHEMBL20003057 | 0.82 | RORC (0.50) | RORCL3MBTL1HTR2AHTR2CKCNH2 | |
| SCHEMBL20002743 | 0.82 | L3MBTL1 (0.48) | RORCL3MBTL1HTR2AHTR2CKCNH2 |
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-3092229-B1 | PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS | BRISTOL MYERS SQUIBB CO (US) | 2018-03-28 | — | — | EP | disclosed |