Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | CDC25B | P30305 | 1/20 | 0.48 |
| ▸ | PGAM1 | P18669 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | DHODH | Q02127 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 2/20 | 0.44 |
| ▸ | MMP9 | P14780 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28435487 | 0.85 | TSHR (0.64) | SMN1; SMN2TSHRPTGS2MEN1KMT2A | |
| SCHEMBL66196 | 0.85 | LMNA (0.59) | SMN1; SMN2TSHRMEN1KMT2APKM | |
| SCHEMBL6914537 | 0.83 | LMNA (0.56) | SMN1; SMN2TSHRMEN1KMT2APKM | |
| Hydrochloric Acid SCHEMBL3278762 | 0.83 | LMNA (0.56) | SMN1; SMN2TSHRMEN1KMT2APKM | |
| SCHEMBL6914794 | 0.83 | LMNA (0.56) | SMN1; SMN2TSHRMEN1KMT2APKM | |
| SCHEMBL6114756 | 0.83 | LMNA (0.56) | SMN1; SMN2TSHRMEN1KMT2APKM | |
| SCHEMBL6916646 | 0.83 | LMNA (0.56) | SMN1; SMN2TSHRMEN1KMT2APKM | |
| SCHEMBL6918593 | 0.83 | LMNA (0.56) | SMN1; SMN2TSHRMEN1KMT2APKM | |
| SCHEMBL6909666 | 0.83 | LMNA (0.56) | SMN1; SMN2TSHRMEN1KMT2APKM | |
| SCHEMBL6912742 | 0.83 | LMNA (0.56) | SMN1; SMN2TSHRMEN1KMT2APKM |
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-109608369-B | Sulfonyl ester group anthraquinone derivative and preparation method and application thereof | 广西大学 | 2021-04-09 | — | — | CN | disclosed |