Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 10/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL20002964 | 0.89 | RORC (0.35) | RORCCYP2C19HDAC3HDAC1HDAC2 | |
| SCHEMBL20003029 | 0.86 | RORC (0.41) | RORCMAPK1 | |
| SCHEMBL20002280 | 0.82 | TACR1 (0.40) | RORCHDAC3HDAC1HDAC2HSD11B1 | |
| SCHEMBL20002167 | 0.80 | KDM1A (0.40) | RORCHTTALDH1A1NPC1RAB9A | |
| SCHEMBL20002352 | 0.79 | MAPT (0.39) | RORCHTTALDH1A1HDAC3HDAC1 | |
| SCHEMBL20003049 | 0.78 | AKR1C3 (0.51) | CYP2C19HTTALDH1A1HSD11B1NPC1 | |
| SCHEMBL20002969 | 0.78 | NOTUM (0.45) | RORCALDH1A1HSD11B1MAPTRAB9A | |
| SCHEMBL20002669 | 0.78 | NOTUM (0.45) | RORCALDH1A1HSD11B1MAPTRAB9A | |
| SCHEMBL20002566 | 0.78 | RORC (0.46) | RORCCYP2C19HTTALDH1A1HSD11B1 | |
| SCHEMBL20002664 | 0.77 | TSHR (0.41) | HSD11B1MAPK1NPC1RAB9A |
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 |