Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 4/20 | 0.40 |
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 4/20 | 0.37 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20002684 | 0.93 | L3MBTL1 (0.47) | L3MBTL1EPHX2HTR2AHTR2CKCNH2 | |
| SCHEMBL20002434 | 0.82 | L3MBTL1 (0.56) | L3MBTL1EPHX2CA12CA1CA2 | |
| SCHEMBL20002381 | 0.82 | L3MBTL1 (0.56) | L3MBTL1EPHX2CA12CA1CA2 | |
| SCHEMBL20002498 | 0.81 | RORC (0.49) | L3MBTL1EPHX2HTR2AHTR2CKCNH2 | |
| SCHEMBL20003057 | 0.80 | RORC (0.50) | L3MBTL1EPHX2HTR2AHTR2CKCNH2 | |
| SCHEMBL20002254 | 0.80 | L3MBTL1 (0.48) | L3MBTL1EPHX2HTR2AHTR2CKCNH2 | |
| SCHEMBL20002731 | 0.80 | L3MBTL1 (0.48) | L3MBTL1EPHX2HTR2AHTR2CKCNH2 | |
| SCHEMBL20002743 | 0.80 | L3MBTL1 (0.48) | L3MBTL1EPHX2HTR2AHTR2CKCNH2 | |
| SCHEMBL20002251 | 0.80 | RORC (0.52) | L3MBTL1ALDH1A1RORCCCR5 | |
| SCHEMBL20002714 | 0.79 | RORC (0.51) | L3MBTL1EPHX2HTR2AHTR2CKCNH2 |
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 |