Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.32 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12802190 | 0.84 | ALDH1A1 (0.40) | ALDH1A1TP53TDP1TRPA1TAS1R3 | |
| SCHEMBL29051208 | 0.84 | ALDH1A1 (0.40) | ALDH1A1TP53TDP1TRPA1TAS1R3 | |
| SCHEMBL12802540 | 0.81 | CNR1 (0.41) | THRB | |
| SCHEMBL16953613 | 0.81 | SRC (0.39) | ALDH1A1TP53TDP1MAPTSLC6A4 | |
| SCHEMBL30701862 | 0.81 | ALDH1A1 (0.37) | ALDH1A1TP53TDP1TRPA1 | |
| SCHEMBL26941360 | 0.81 | ALDH1A1 (0.37) | ALDH1A1TP53TDP1TRPA1TAS1R3 | |
| SCHEMBL19416753 | 0.81 | TDP1 (0.39) | ALDH1A1TP53TDP1TRPA1TAS1R3 | |
| SCHEMBL16952356 | 0.81 | TP53 (0.39) | ALDH1A1TP53TDP1TRPA1TAS1R3 | |
| SCHEMBL16957489 | 0.79 | LMNA (0.38) | MAPTSLC6A2SLC6A4THRB | |
| SCHEMBL16954372 | 0.79 | HPGD (0.37) | ALDH1A1CHRNB2CHRNA7CHRNA4MAPT |
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-114057671-B | Diepoxyaromatic phenol and preparation method thereof, hyperbranched phenolic amine epoxy curing agent and preparation method thereof | 万华化学集团股份有限公司 | 2023-08-11 | — | — | CN | disclosed |