Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 9/20 | 0.45 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KAT2B | Q92831 | 3/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8031072 | 0.80 | POLB (0.40) | ALDH1A1POLBMAPTHTTGAA | |
| SCHEMBL8090673 | 0.78 | SERPINE1 (0.55) | ALDH1A1POLBMAPTHTTGAA | |
| SCHEMBL8201947 | 0.77 | ALDH1A1 (0.45) | ALDH1A1POLBMAPTGSTM2TDP1 | |
| SCHEMBL8043013 | 0.76 | MAPK1 (0.41) | ALDH1A1POLBMAPTHTTGAA | |
| SCHEMBL8203750 | 0.76 | GSTM2 (0.54) | ALDH1A1MAPTGSTM2HTTPRSS1 | |
| SCHEMBL27499600 | 0.75 | ALDH1A1 (0.41) | ALDH1A1POLBMAPTHTTGAA | |
| SCHEMBL18784822 | 0.75 | BCL6 (0.51) | ALDH1A1MAPTGSTM2HTTGAA | |
| SCHEMBL864476 | 0.74 | GSTM2 (0.52) | ALDH1A1MAPTGSTM2PRSS1TSHR | |
| SCHEMBL22636966 | 0.74 | AR (0.42) | ALDH1A1MAPTHTTTSHRLMNA | |
| SCHEMBL11199799 | 0.74 | MAPT (0.68) | ALDH1A1POLBMAPTHTTGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-6121264-A | GLUTAMATE RECEPTOR ANTAGONIST, AMPA RECEPTOR ANTAGONIST, NMDA-GLYCINE RECEPTOR ANTAGONIST, KAINIC ACID NEUROTOXICITY INHIBITOR, ANTIISCHEMIC AGENT, PSYCHOTROPIC AGENT | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 2000-09-19 | — | — | US | disclosed |
| EP-0919554-A1 | IMIDAZOLE-SUBSTITUTED QUINOXALINEDIONE DERIVATIVES | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1999-06-02 | — | — | EP | disclosed |