Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | BRD2 | P25440 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2560869 | 0.82 | PIK3CD (0.47) | PIK3CDKMT2AMEN1PKMBRD4 | |
| SCHEMBL17688542 | 0.80 | PIK3CD (0.43) | PIK3CDKMT2AMEN1PKMTSHR | |
| SCHEMBL261644 | 0.80 | PIK3CD (0.58) | PIK3CDKMT2AMEN1PKMBRD4 | |
| SCHEMBL2451758 | 0.80 | PIK3CD (0.46) | PIK3CDKMT2AMEN1PKMBRD4 | |
| SCHEMBL14235642 | 0.79 | TSHR (0.48) | PIK3CDKMT2AMEN1PKMBRD4 | |
| SCHEMBL17688551 | 0.79 | — | — | |
| SCHEMBL10043 | 0.77 | — | — | |
| SCHEMBL17688541 | 0.77 | KMT2A (0.45) | PIK3CDKMT2ATSHRALDH1A1 | |
| SCHEMBL5424673 | 0.76 | PIK3CD (0.54) | PIK3CDKMT2AMEN1PKMBRD4 | |
| SCHEMBL2559744 | 0.76 | L3MBTL1 (0.43) | PIK3CDKMT2AMEN1PKMTSHR |
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-2016061393-A1 | FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE | XENOPORT, INC. (US) | 2016-04-21 | — | — | WO | disclosed |