Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.37 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.37 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL18009297 | 0.94 | MAPT (0.40) | ALDH1A1SMN1; SMN2KMT2AMEN1PIK3CD | |
| SCHEMBL18009294 | 0.90 | MMP2 (0.46) | ALDH1A1SMN1; SMN2MMP2KMT2AMEN1 | |
| SCHEMBL18009292 | 0.87 | PIK3CD (0.41) | ALDH1A1SMN1; SMN2MMP2KMT2APIK3CD | |
| SCHEMBL18009300 | 0.85 | PIK3CD (0.42) | ALDH1A1SMN1; SMN2MMP2KMT2AMEN1 | |
| SCHEMBL18009461 | 0.85 | PIK3CD (0.40) | ALDH1A1SMN1; SMN2MMP2KMT2AMEN1 | |
| SCHEMBL18007448 | 0.84 | MEN1 (0.38) | ALDH1A1SMN1; SMN2KMT2AMEN1PIK3CD | |
| SCHEMBL18007451 | 0.83 | PIK3CD (0.39) | ALDH1A1SMN1; SMN2MMP2KMT2AMEN1 | |
| SCHEMBL18009336 | 0.82 | MMP2 (0.42) | ALDH1A1MMP2 | |
| SCHEMBL18007455 | 0.82 | NAMPT (0.35) | SMN1; SMN2MMP2KMT2AMEN1PIK3CD | |
| SCHEMBL18009293 | 0.81 | KDM4E (0.42) | ALDH1A1SMN1; SMN2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016127186-A1 | FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE | NGUYEN MARK QUANG (US) | 2016-08-11 | — | — | WO | disclosed |