Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 16/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5535845 | 0.80 | SIGMAR1 (0.45) | SIGMAR1 | |
| SCHEMBL8765716 | 0.72 | SIGMAR1 (0.47) | SIGMAR1 | |
| SCHEMBL129446 | 0.72 | SIGMAR1 (0.51) | SIGMAR1ALDH1A1L3MBTL1 | |
| SCHEMBL30966769 | 0.72 | SIGMAR1 (0.51) | SIGMAR1ALDH1A1L3MBTL1 | |
| SCHEMBL17485887 | 0.72 | SIGMAR1 (0.51) | SIGMAR1 | |
| SCHEMBL14236879 | 0.71 | SIGMAR1 (0.46) | SIGMAR1 | |
| Hydrochloric Acid SCHEMBL2867283 | 0.71 | SIGMAR1 (0.53) | SIGMAR1ALDH1A1LMNAMAPT | |
| SCHEMBL12957222 | 0.71 | TP53 (0.54) | SIGMAR1LMNAMAPT | |
| SCHEMBL1529253 | 0.71 | SIGMAR1 (0.50) | SIGMAR1 | |
| SCHEMBL3385658 | 0.71 | ALDH1A1 (0.59) | SIGMAR1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105164104-B | Urea derivative and its purposes as fatty acid binding protein (FABP) inhibitor | 豪夫迈·罗氏有限公司 | 2019-04-12 | — | — | CN | disclosed |