Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 6/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20002748 | 0.89 | RORC (0.39) | RORCALDH1A1GAAMAPTRAB9A | |
| SCHEMBL20003110 | 0.88 | RORC (0.41) | RORCCYP3A4 | |
| SCHEMBL20003111 | 0.85 | RORC (0.36) | RORCALDH1A1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL20002678 | 0.80 | RORC (0.58) | RORCCYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL20002166 | 0.78 | RORC (0.40) | RORCCYP3A4CYP2C19ALDH1A1GAA | |
| SCHEMBL20003052 | 0.76 | HSD11B1 (0.38) | RORCALDH1A1GAAMAPTRAB9A | |
| SCHEMBL20002171 | 0.76 | KMT2A (0.38) | RORCMAPTRAB9ASMN1; SMN2HSD11B1 | |
| SCHEMBL20002187 | 0.76 | RORC (0.44) | RORCALDH1A1GAAMAPTRAB9A | |
| SCHEMBL20002819 | 0.76 | RORC (0.44) | RORCALDH1A1GAAMAPTRAB9A | |
| SCHEMBL20003044 | 0.76 | RORC (0.40) | RORCALDH1A1GAAMAPTRAB9A |
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 |