Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | SRC | P12931 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.44 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | ERN1 | O75460 | 2/20 | 0.43 |
| ▸ | TLR2 | O60603 | 2/20 | 0.43 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.43 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1942511 | 0.94 | ALDH1A1 (0.53) | ALDH1A1HPGDHTTSMN1; SMN2MAPT | |
| SCHEMBL29441808 | 0.94 | ALDH1A1 (0.53) | ALDH1A1HPGDHTTSMN1; SMN2MAPT | |
| Alcohol SCHEMBL27887077 | 0.93 | ALDH1A1 (0.50) | ALDH1A1HPGDHTTSMN1; SMN2MAPT | |
| SCHEMBL4730558 | 0.75 | PRMT1 (0.55) | ALDH1A1HPGDMAPTSRCLMNA | |
| Methyl Alcohol SCHEMBL28108595 | 0.73 | ALDH1A1 (0.55) | ALDH1A1HPGDHTTSMN1; SMN2SRC | |
| SCHEMBL1531308 | 0.72 | CA2 (0.48) | ALDH1A1HPGDHTTSMN1; SMN2MAPT | |
| SCHEMBL7363630 | 0.72 | ALDH1A1 (0.70) | ALDH1A1HPGDHTTSMN1; SMN2MAPT | |
| SCHEMBL554351 | 0.72 | PTGDR2 (0.50) | ALDH1A1HPGDHTTSMN1; SMN2MAPT | |
| 2-Nitrobenzaldehyde SCHEMBL28121927 | 0.72 | ERN1 (0.65) | ALDH1A1SMN1; SMN2MAPTKMT2AGAA | |
| SCHEMBL1765172 | 0.71 | ALDH1A1 (0.63) | ALDH1A1HPGDHTTSMN1; SMN2MAPT |
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-115368330-B | Schiff base trehalase inhibitor and preparation method and application thereof | 河南农业大学 | 2024-03-12 | — | — | CN | disclosed |