Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | GPX4 | P36969 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2808762 | 0.91 | ALDH1A1 (0.48) | ALDH1A1CYP3A4GFERHPGDTDP1 | |
| SCHEMBL1029104 | 0.85 | GFER (0.46) | ALDH1A1CYP3A4GFERHPGDTDP1 | |
| SCHEMBL13645033 | 0.84 | POLB (0.43) | ALDH1A1CYP3A4GFERHPGDTDP1 | |
| SCHEMBL397442 | 0.84 | GFER (0.54) | ALDH1A1CYP3A4GFERHPGDHTT | |
| SCHEMBL13645027 | 0.84 | ALOX15 (0.46) | ALDH1A1CYP3A4GFERHPGDTDP1 | |
| Hydrochloric Acid SCHEMBL11594933 | 0.83 | GFER (0.53) | ALDH1A1CYP3A4GFERHPGDHTT | |
| SCHEMBL10981877 | 0.82 | ALDH1A1 (0.53) | ALDH1A1CYP3A4GFERHPGDTDP1 | |
| SCHEMBL26558157 | 0.82 | BLM (0.44) | ALDH1A1HPGDRAB9ANPC1MEN1 | |
| SCHEMBL1132513 | 0.82 | ALDH1A1 (0.53) | ALDH1A1CYP3A4TDP1RAB9ANPC1 | |
| SCHEMBL30565134 | 0.82 | ALDH1A1 (0.61) | ALDH1A1CYP3A4GFERHPGDTDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117964504-A | Preparation method of gem-difluoroallylglycine or polypeptide derivative | 南京林业大学 | 2024-05-03 | — | — | CN | disclosed |
| CN-109734713-B | 3-imido imidazo [1,2-a ] pyridine compound | 东华理工大学 | 2021-06-04 | — | — | CN | disclosed |
| CN-112566675-A | Freshening compositions comprising controlled release modulators | 阿里莱森斯有限公司 | 2021-03-26 | — | — | CN | disclosed |