Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SGMS2 | Q8NHU3 | 4/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | GRM5 | P41594 | 1/20 | 0.48 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL28847163 | 1.00 | SGMS2 (0.58) | SGMS2MAPK1GRM5KCNMA1LMNA | |
| SCHEMBL28847154 | 0.93 | MAPK1 (0.53) | SGMS2MAPK1GRM5KCNMA1LMNA | |
| SCHEMBL28847156 | 0.90 | MAPT (0.54) | SGMS2KCNMA1MAPTPKML3MBTL1 | |
| SCHEMBL29950316 | 0.90 | MAPT (0.54) | SGMS2KCNMA1MAPTPKML3MBTL1 | |
| SCHEMBL28847223 | 0.78 | PTPN1 (0.50) | LMNAMAPTTP53MEN1GAA | |
| SCHEMBL28304118 | 0.78 | POLB (0.53) | SGMS2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL29950288 | 0.75 | SGMS2 (0.50) | SGMS2LMNAALDH1A1MAPTPKM | |
| SCHEMBL29950308 | 0.74 | MAPT (0.52) | SGMS2LMNAMAPTPKML3MBTL1 | |
| SCHEMBL17551830 | 0.74 | SGMS2 (1.00) | SGMS2 | |
| SCHEMBL17551815 | 0.74 | SGMS2 (1.00) | SGMS2 |
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-109836378-B | Sphingomyelin synthase inhibitor, preparation method and application thereof | 上海华汇拓医药科技有限公司 | 2022-09-30 | — | — | CN | disclosed |