Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 2/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3062998 | 0.81 | MMP1 (0.45) | SMN1; SMN2CA12CA1CA9ALDH1A1 | |
| SCHEMBL3068967 | 0.81 | MMP1 (0.45) | SMN1; SMN2CA12CA1CA9ALDH1A1 | |
| SCHEMBL3065969 | 0.81 | MMP1 (0.45) | SMN1; SMN2CA12CA1CA9ALDH1A1 | |
| SCHEMBL14602765 | 0.79 | SMN1; SMN2 (0.50) | SMN1; SMN2CA12CA1CA9ALDH1A1 | |
| SCHEMBL6263459 | 0.77 | ALDH1A1 (0.44) | ALDH1A1GAAMMP8MMP1MMP3 | |
| SCHEMBL7375349 | 0.77 | SMN1; SMN2 (0.48) | SMN1; SMN2CA12CA1CA9ALDH1A1 | |
| SCHEMBL27466214 | 0.76 | CYP3A4 (0.47) | SMN1; SMN2ALDH1A1CYP3A4CYP2C19GAA | |
| SCHEMBL762984 | 0.76 | SMN1; SMN2 (0.52) | SMN1; SMN2CA12CA1CA9ALDH1A1 | |
| SCHEMBL27853914 | 0.76 | SMN1; SMN2 (0.46) | SMN1; SMN2CA12CA1CA9ALDH1A1 | |
| SCHEMBL2115037 | 0.76 | SMN1; SMN2 (0.52) | SMN1; SMN2CA12CA1CA9ALDH1A1 |
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-1152910-A | Difluorostatone antiviral agents | MERRELL PHARMA INC (US) | 1997-06-25 | — | — | CN | disclosed |