Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | RORC | P51449 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TACR3 | P29371 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20002759 | 0.85 | GFER (0.43) | HSD11B1GAAMEN1KMT2AALDH1A1 | |
| SCHEMBL20002698 | 0.82 | HSD11B1 (0.47) | HSD11B1MEN1KMT2AALDH1A1RORC | |
| SCHEMBL20002706 | 0.82 | HSD11B1 (0.47) | HSD11B1MEN1KMT2AALDH1A1RORC | |
| SCHEMBL20002995 | 0.81 | GFER (0.50) | HSD11B1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL20002574 | 0.80 | ALDH1A1 (0.51) | MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL20002641 | 0.79 | TDP1 (0.42) | HSD11B1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL20003010 | 0.78 | RORC (0.43) | MTNR1BALDH1A1RORC | |
| SCHEMBL20003089 | 0.78 | GPR183 (0.45) | HSD11B1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL20002705 | 0.78 | ALDH1A1 (0.41) | HSD11B1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL20002746 | 0.77 | CCR5 (0.44) | HSD11B1MEN1KMT2AALDH1A1SMN1; SMN2 |
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 |