Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 4/20 | 0.34 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.34 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.34 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | DNMT1 | P26358 | 3/20 | 0.33 |
| ▸ | KIF11 | P52732 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7322653 | 1.00 | PDK2 (0.34) | PDK2SLC1A2SLC1A3SLC1A1NPC1 | |
| SCHEMBL7325924 | 0.89 | SLC1A3 (0.41) | PDK2SLC1A2SLC1A3SLC1A1ALDH1A1 | |
| SCHEMBL7325928 | 0.89 | SLC1A3 (0.41) | PDK2SLC1A2SLC1A3SLC1A1ALDH1A1 | |
| SCHEMBL7316689 | 0.87 | KIF11 (0.36) | PDK2SLC1A2SLC1A3SLC1A1ALDH1A1 | |
| SCHEMBL7316697 | 0.87 | KIF11 (0.36) | PDK2SLC1A2SLC1A3SLC1A1ALDH1A1 | |
| SCHEMBL7317186 | 0.87 | NPC1 (0.37) | PDK2SLC1A2NPC1ALDH1A1PLA2G1B | |
| SCHEMBL7317182 | 0.87 | NPC1 (0.37) | PDK2SLC1A2NPC1ALDH1A1PLA2G1B | |
| SCHEMBL7313467 | 0.86 | PDK2 (0.36) | PDK2SLC1A2SLC1A3SLC1A1 | |
| SCHEMBL7313476 | 0.86 | PDK2 (0.36) | PDK2SLC1A2SLC1A3SLC1A1 | |
| SCHEMBL7315669 | 0.85 | PDK2 (0.39) | PDK2SLC1A2SLC1A3SLC1A1NPC1 |
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-6162824-A | NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS | ALLELIX NEUROSCIENCE INC. | 2000-12-19 | — | — | US | disclosed |