Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CES2 | O00748 | 2/20 | 0.38 |
| ▸ | CES1 | P23141 | 2/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28858450 | 1.00 | MEN1 (0.44) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL28858458 | 0.81 | CES1 (0.46) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL28858456 | 0.81 | CES1 (0.46) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL8921796 | 0.76 | MEN1 (0.45) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL10995634 | 0.76 | MEN1 (0.45) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL5639403 | 0.76 | MEN1 (0.50) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL5639401 | 0.76 | MEN1 (0.50) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL8565313 | 0.76 | MEN1 (0.50) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL7175389 | 0.76 | MEN1 (0.45) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 | |
| SCHEMBL11602973 | 0.74 | MEN1 (0.44) | MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1 |
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-115197046-B | Halogenation method of unsaturated hydrocarbon | 华南理工大学 | 2023-12-15 | — | — | CN | disclosed |
| CN-115197046-A | Halogenation method of unsaturated hydrocarbon | 华南理工大学 | 2022-10-18 | — | — | CN | disclosed |
| CN-109400440-B | Halogenated conjugated 1, 3-eneyne compound and preparation method and application thereof | 浙江工业大学 | 2021-10-15 | — | — | CN | disclosed |