Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | CASR | P41180 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | ALPL | P05186 | 1/20 | 0.43 |
| ▸ | ALPI | P09923 | 1/20 | 0.43 |
| ▸ | ALPG | P10696 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 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 | |
|---|---|---|---|---|
| SCHEMBL27929589 | 0.85 | KMT2A (0.43) | ALDH1A1MAPTMEN1KMT2ALMNA | |
| SCHEMBL27979447 | 0.84 | MAPT (0.50) | MAPTTP53MEN1KMT2ALMNA | |
| SCHEMBL29157112 | 0.81 | CTSA (0.52) | ALDH1A1HPGDMAPTTP53THRB | |
| SCHEMBL11194241 | 0.78 | MAPT (0.51) | ALDH1A1HPGDMAPTTP53THRB | |
| SCHEMBL11195367 | 0.76 | CASR (0.57) | ALDH1A1HPGDMAPTTP53THRB | |
| SCHEMBL11204046 | 0.76 | CASR (0.54) | ALDH1A1HPGDMAPTTP53THRB | |
| SCHEMBL11198968 | 0.76 | CASR (0.56) | ALDH1A1HPGDMAPTTP53THRB | |
| SCHEMBL11339180 | 0.75 | MAPT (0.49) | ALDH1A1HPGDMAPTTP53THRB | |
| SCHEMBL27979451 | 0.75 | ALDH1A1 (0.50) | ALDH1A1HPGDMAPTTP53THRB | |
| SCHEMBL2639604 | 0.75 | NPC1 (0.54) | ALDH1A1HPGDMAPTTP53THRB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104876829-B | The method of beta-amino carbonyl compound is prepared in polyacrylic acid heterogeneous catalysis | 陕西师范大学 | 2016-08-24 | — | — | CN | disclosed |
| CN-104045573-B | The method of beta-amino carbonyl compound is prepared in cyclopentadienyl titanium dichloride and the concerted catalysis of aminophenols part | SHAANXI NORMAL UNIVERSITY (CN) | 2015-10-28 | — | — | CN | disclosed |
| CN-104876829-A | Method for preparing beta-amino carbonyl compound through polyacrylic acid heterogeneous catalysis | UNIV SHAANXI NORMAL | 2015-09-02 | — | — | CN | disclosed |
| CN-104045573-A | Method for preparing beta-amino carbonyl compound through synergetic catalysis of titanocene dichloride and aminophenol ligand | UNIV SHAANXI NORMAL | 2014-09-17 | — | — | CN | disclosed |