Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.44 |
| ▸ | MGLL | Q99685 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7520759 | 0.89 | LMNA (0.49) | LMNAHSD11B1MGLLL3MBTL1ALDH1A1 | |
| SCHEMBL7520594 | 0.82 | LMNA (0.48) | LMNAHSD11B1MGLLL3MBTL1ALDH1A1 | |
| SCHEMBL13723607 | 0.80 | SMN1; SMN2 (0.35) | LMNAALDH1A1KMT2A | |
| SCHEMBL7520771 | 0.78 | POLB (0.43) | LMNAHSD11B1MGLLALDH1A1DRD2 | |
| SCHEMBL13722650 | 0.78 | SMN1; SMN2 (0.43) | HTTKMT2A | |
| SCHEMBL7521184 | 0.76 | HDAC3 (0.42) | ALDH1A1DRD2HPGDTSHRHTT | |
| SCHEMBL7520491 | 0.75 | HTT (0.43) | LMNAMGLLHTTMEN1KMT2A | |
| SCHEMBL7522027 | 0.75 | LMNA (0.46) | LMNAHSD11B1ALDH1A1TP53HPGD | |
| SCHEMBL8825345 | 0.75 | ACHE (0.56) | LMNAHSD11B1MGLLL3MBTL1ALDH1A1 | |
| SCHEMBL7523356 | 0.74 | MGLL (0.47) | LMNAHSD11B1MGLLALDH1A1HTT |
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-2097387-B1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2016-05-04 | — | — | EP | disclosed |