Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | PYGL | P06737 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL8079285 | 0.85 | CES2 (0.49) | GAAPKML3MBTL1RAB9AMAPK14 | |
| SCHEMBL28399803 | 0.84 | GAA (0.50) | NPC1ALDH1A1LMNAGAAPKM | |
| SCHEMBL4694883 | 0.81 | GAA (0.56) | NPC1ALDH1A1LMNAGAAPKM | |
| SCHEMBL8077694 | 0.79 | MAPT (0.41) | LMNAMAPTRAB9ASRD5A2MAPK1 | |
| SCHEMBL8064210 | 0.79 | LTA4H (0.48) | NPC1ALDH1A1LMNAGAAHPGD | |
| SCHEMBL8611329 | 0.78 | NPC1 (0.53) | NPC1ALDH1A1LMNAGAAPKM | |
| SCHEMBL2861947 | 0.77 | HPGD (0.61) | NPC1ALDH1A1LMNAGAAPKM | |
| SCHEMBL8079269 | 0.75 | CES2 (0.52) | NPC1ALDH1A1LMNAHPGDMAPT | |
| SCHEMBL10914230 | 0.75 | SMN1; SMN2 (0.44) | NPC1ALDH1A1LMNAGAAPKM | |
| SCHEMBL28464953 | 0.75 | MAPT (0.52) | NPC1ALDH1A1LMNAGAAPKM |
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-6166072-A | Amino acid derivatives | ALLELIX NEUROSCIENCE, INC. (CA) | 2000-12-26 | — | — | US | disclosed |
| WO-1999034790-A1 | GLYCINE TRANSPORT INHIBITORS | ALLELIX NEUROSCIENCE, INC. (US) | 1999-07-15 | — | — | WO | disclosed |