Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | FDPS | P14324 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.56 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.56 |
| ▸ | ABAT | P80404 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.56 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | TTR | P02766 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL14571893 | 0.86 | ALDH1A1 (0.58) | ALDH1A1TSHRFDPSHPGDTRIM24 | |
| SCHEMBL15857953 | 0.86 | ALDH1A1 (0.62) | ALDH1A1TSHRFDPSHPGDTRIM24 | |
| SCHEMBL30271611 | 0.85 | ALDH1A1 (0.66) | ALDH1A1TSHRFDPSHPGDTRIM24 | |
| SCHEMBL13521532 | 0.85 | ALDH1A1 (0.66) | ALDH1A1TSHRFDPSHPGDTRIM24 | |
| SCHEMBL13644446 | 0.85 | ALDH1A1 (0.66) | ALDH1A1TSHRFDPSHPGDTRIM24 | |
| SCHEMBL25228293 | 0.82 | ALDH1A1 (0.61) | ALDH1A1TSHRFDPSHPGDTRIM24 | |
| SCHEMBL16839628 | 0.82 | ALDH1A1 (0.61) | ALDH1A1TSHRFDPSHPGDTRIM24 | |
| SCHEMBL29452432 | 0.82 | ALDH1A1 (0.61) | ALDH1A1TSHRFDPSHPGDTRIM24 | |
| SCHEMBL11545585 | 0.82 | ALDH1A1 (0.61) | ALDH1A1TSHRFDPSHPGDTRIM24 | |
| SCHEMBL10031796 | 0.82 | ALDH1A1 (0.61) | ALDH1A1TSHRFDPSHPGDTRIM24 |
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-116986977-A | Halogenated chalcone derivative, preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2023-11-03 | — | — | CN | disclosed |