Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.58 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.45 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.40 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.40 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CDC25A | P30304 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5069431 | 0.98 | ALDH1A1 (0.56) | ALDH1A1HSD17B10HPGDBCL2L1BACE1 | |
| SCHEMBL10356132 | 0.89 | HPGD (0.43) | ALDH1A1HSD17B10HPGDBCL2L1BACE1 | |
| SCHEMBL28404461 | 0.85 | HPGD (0.50) | ALDH1A1HSD17B10HPGDBCL2L1BACE1 | |
| SCHEMBL23877934 | 0.84 | ESR2 (0.45) | ALDH1A1HSD17B10HPGDBCL2L1BACE1 | |
| SCHEMBL16527993 | 0.82 | GABRA1 (0.46) | ALDH1A1HSD17B10HPGDBCL2L1GABRA1 | |
| SCHEMBL28423706 | 0.82 | CDC25A (0.44) | ALDH1A1HSD17B10HPGDBCL2L1BACE1 | |
| SCHEMBL4191555 | 0.81 | HSD17B1 (0.45) | ESR2 | |
| SCHEMBL10818953 | 0.80 | BACE1 (0.45) | ALDH1A1HSD17B10HPGDBCL2L1BACE1 | |
| SCHEMBL27601367 | 0.80 | BACE1 (0.45) | ALDH1A1HSD17B10HPGDBCL2L1BACE1 | |
| SCHEMBL6838848 | 0.80 | CDC25A (0.41) | ALDH1A1HSD17B10HPGDBCL2L1BACE1 |
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-105308162-B | Compounds for the controlled release of active molecules | 弗门尼舍有限公司 | 2022-10-11 | — | — | CN | disclosed |