Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | TNF | P01375 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15654288 | 0.86 | NPC1 (0.54) | NPC1ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL7365092 | 0.85 | ALDH1A1 (0.50) | NPC1ALDH1A1MAPTLMNAKDM4E | |
| Hydrochloric Acid SCHEMBL7172679 | 0.84 | ALDH1A1 (0.49) | NPC1ALDH1A1MAPTLMNAKDM4E | |
| SCHEMBL6517068 | 0.83 | PPARG (0.47) | NPC1ALDH1A1MAPTLMNAKDM4E | |
| SCHEMBL3821977 | 0.80 | MAPT (0.49) | NPC1ALDH1A1MAPTLMNAKDM4E | |
| SCHEMBL11736234 | 0.80 | NPC1 (0.69) | NPC1ALDH1A1MAPTLMNAKDM4E | |
| SCHEMBL4710743 | 0.80 | GAA (0.52) | NPC1ALDH1A1MAPTLMNAKDM4E | |
| SCHEMBL22076568 | 0.80 | NPC1 (0.60) | NPC1ALDH1A1MAPTLMNAKDM4E | |
| SCHEMBL5700869 | 0.80 | KMT2A (0.44) | ALDH1A1MAPTLMNAKDM4EMEN1 | |
| SCHEMBL5700864 | 0.80 | KMT2A (0.44) | ALDH1A1MAPTLMNAKDM4EMEN1 |
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-113845485-B | Amino acid derivative and preparation method and application thereof | 湖南中医药大学 | 2023-03-14 | — | — | CN | disclosed |