Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.50 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8005511 | 1.00 | SIGMAR1 (0.50) | SIGMAR1KCNQ2L3MBTL1ALDH1A1MAPT | |
| SCHEMBL8008257 | 0.84 | SIGMAR1 (0.52) | SIGMAR1KCNQ2CCR3 | |
| SCHEMBL8008253 | 0.84 | SIGMAR1 (0.52) | SIGMAR1KCNQ2CCR3 | |
| SCHEMBL7715909 | 0.83 | KCNQ2 (0.48) | SIGMAR1KCNQ2L3MBTL1ALDH1A1MAPT | |
| SCHEMBL8006026 | 0.78 | SIGMAR1 (0.51) | SIGMAR1KCNQ2ALDH1A1 | |
| SCHEMBL8007922 | 0.73 | ADRA1D (0.62) | — | |
| SCHEMBL5092054 | 0.71 | MAPT (0.55) | SIGMAR1L3MBTL1ALDH1A1MAPTMEN1 | |
| SCHEMBL7996443 | 0.70 | HTT (0.47) | L3MBTL1ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL8005302 | 0.69 | KCNQ2 (0.47) | SIGMAR1KCNQ2CCR3DRD2 | |
| SCHEMBL6972893 | 0.69 | ALDH1A1 (0.47) | SIGMAR1L3MBTL1ALDH1A1MAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6143750-A | NITROGEN HETEROCYCLIC COMPOUNDS AS ENZYME INHIBITORS, FOR PROSTATE PROBLEMS AND MUSCLE RELAXANTS | MERCK & CO., INC. (US) | 2000-11-07 | — | — | US | disclosed |