Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.34 |
| ▸ | FYN | P06241 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
| ▸ | RET | P07949 | 1/20 | 0.34 |
| ▸ | MET | P08581 | 1/20 | 0.34 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | FLT3 | P36888 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.34 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.34 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL648324 | 0.81 | ALDH1A1 (0.39) | ALDH1A1HDAC2DAPK3JAK2ABL1 | |
| SCHEMBL29065939 | 0.80 | ALDH1A1 (0.46) | ALDH1A1HDAC2DAPK3JAK2ABL1 | |
| SCHEMBL28466430 | 0.77 | ALDH1A1 (0.42) | ALDH1A1HDAC2DAPK3JAK2ABL1 | |
| SCHEMBL16174757 | 0.77 | ALDH1A1 (0.42) | ALDH1A1HDAC2DAPK3JAK2ABL1 | |
| SCHEMBL1900832 | 0.76 | PTGS2 (0.38) | ALDH1A1TSHRTDP1 | |
| SCHEMBL904407 | 0.75 | ALDH1A1 (0.50) | ALDH1A1TDP1 | |
| SCHEMBL23464382 | 0.74 | ALDH1A1 (0.44) | ALDH1A1HDAC2DAPK3JAK2ABL1 | |
| SCHEMBL30560581 | 0.74 | ALDH1A1 (0.48) | ALDH1A1HDAC2DAPK3JAK2ABL1 | |
| SCHEMBL6571378 | 0.73 | ALDH1A1 (0.42) | ALDH1A1HDAC2DAPK3JAK2ABL1 | |
| SCHEMBL28694640 | 0.72 | KDM4E (0.39) | ALDH1A1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116715594-B | Star-shaped micromolecule crosslinked hole transport material and preparation method and application thereof | 天津大学 | 2023-12-15 | — | — | CN | disclosed |
| CN-116715594-A | Star-shaped micromolecule crosslinked hole transport material and preparation method and application thereof | 天津大学 | 2023-09-08 | — | — | CN | disclosed |