Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | RORC | P51449 | 3/20 | 0.40 |
| ▸ | CYP46A1 | Q9Y6A2 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20002751 | 0.90 | NOTUM (0.42) | L3MBTL1RORCMAPT | |
| SCHEMBL20002706 | 0.89 | HSD11B1 (0.47) | HSD11B1L3MBTL1RORCALDH1A1 | |
| SCHEMBL20002698 | 0.89 | HSD11B1 (0.47) | HSD11B1L3MBTL1RORCALDH1A1 | |
| SCHEMBL20002400 | 0.87 | TACR3 (0.42) | HSD11B1L3MBTL1RORCCA12CA1 | |
| SCHEMBL20002286 | 0.87 | TACR1 (0.45) | RORC | |
| SCHEMBL20002564 | 0.87 | NAMPT (0.41) | HSD11B1L3MBTL1CYP46A1ALDH1A1 | |
| SCHEMBL22662762 | 0.86 | SLC6A9 (0.43) | RORC | |
| SCHEMBL20002863 | 0.86 | L3MBTL1 (0.39) | HSD11B1L3MBTL1RORCCYP46A1CA12 | |
| SCHEMBL20002854 | 0.85 | RORC (0.42) | HSD11B1L3MBTL1RORCCYP46A1CA12 | |
| SCHEMBL20002340 | 0.84 | TACR3 (0.39) | L3MBTL1CYP46A1ALDH1A1 |
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 |