Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 17/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7316770 | 0.82 | PDK2 (0.43) | PDK2ALDH1A1 | |
| SCHEMBL7316176 | 0.82 | PDK2 (0.50) | PDK2ALDH1A1NFKB1NFKB2RELA | |
| SCHEMBL7325164 | 0.79 | NPC1 (0.44) | PDK2NPC1ALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL7323011 | 0.78 | PDK2 (0.53) | PDK2 | |
| SCHEMBL7322740 | 0.78 | PDK2 (0.53) | PDK2NPC1ALDH1A1RAB9AL3MBTL1 | |
| SCHEMBL7320725 | 0.78 | PDK2 (0.51) | PDK2 | |
| SCHEMBL24406612 | 0.76 | NPC1 (0.41) | PDK2NPC1ALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL18563492 | 0.73 | MAPT (0.40) | PDK2NPC1ALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL29163458 | 0.73 | ALDH1A1 (0.43) | PDK2NPC1ALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL11885258 | 0.71 | ALDH1A1 (0.39) | PDK2NPC1ALDH1A1PLA2G1BNFKB1 |
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 |