Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 5/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | MGLL | Q99685 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20002981 | 0.81 | KDM4E (0.55) | HSD11B1ALDH1A1L3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL20002399 | 0.78 | NAMPT (0.50) | MGLL | |
| SCHEMBL6211084 | 0.72 | HSD11B1 (0.91) | HSD11B1MGLLMEN1KMT2A | |
| SCHEMBL20002698 | 0.72 | HSD11B1 (0.47) | HSD11B1ALDH1A1L3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL20002706 | 0.72 | HSD11B1 (0.47) | HSD11B1ALDH1A1L3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL20002958 | 0.71 | NOTUM (0.48) | HSD11B1ALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL20002751 | 0.71 | NOTUM (0.42) | L3MBTL1 | |
| SCHEMBL20002969 | 0.71 | NOTUM (0.45) | HSD11B1ALDH1A1L3MBTL1SMN1; SMN2KMT2A | |
| SCHEMBL20002167 | 0.71 | KDM1A (0.40) | ALDH1A1CYP2D6HTTSMN1; SMN2 | |
| SCHEMBL20002280 | 0.71 | TACR1 (0.40) | HSD11B1 |
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 |