Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL20343418 | 0.77 | HSD11B1 (0.41) | HSD11B1ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL15077584 | 0.73 | HSD11B1 (0.46) | HSD11B1ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL23317431 | 0.71 | HRH3 (0.36) | ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL16199664 | 0.70 | JAK2 (0.39) | HSD11B1MEN1MAPTKMT2A | |
| SCHEMBL20343397 | 0.70 | JAK2 (0.39) | HSD11B1MEN1MAPTKMT2A | |
| SCHEMBL20343675 | 0.70 | PHGDH (0.36) | ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL22681138 | 0.66 | HSD11B1 (0.40) | HSD11B1 | |
| SCHEMBL20343384 | 0.64 | JAK2 (0.31) | — | |
| SCHEMBL16731051 | 0.64 | JAK3 (0.35) | ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL771299 | 0.61 | HSD11B1 (0.50) | HSD11B1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2796460-B1 | PYRROLE SIX-MEMBERED HETEROARYL RING DERIVATIVE, PREPARATION METHOD THEREFOR, AND MEDICINAL USES THEREOF | JIANGSU HENGRUI MEDICINE CO (CN) | 2018-07-04 | — | — | EP | disclosed |
| EP-3312164-A1 | SUBSTITUTED HETEROARYL COMPOUNDS AND METHODS OF USE | Calitor Sciences, LLC (US) | 2018-04-25 | — | — | EP | disclosed |