Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25A | P30304 | 14/20 | 0.59 |
| ▸ | CDC25B | P30305 | 11/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | INPP5D | Q92835 | 2/20 | 0.49 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.49 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.49 |
| ▸ | EFNA1 | P20827 | 1/20 | 0.49 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.49 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.49 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.49 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.49 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.49 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.49 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.49 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL19866272 | 0.86 | CYP2D6 (0.71) | CDC25ACDC25BCYP2D6CYP2C19INPP5D | |
| SCHEMBL7126727 | 0.86 | CYP2D6 (0.71) | CDC25ACDC25BCYP2D6CYP2C19INPP5D | |
| SCHEMBL288945 | 0.86 | CYP2D6 (0.71) | CDC25ACDC25BCYP2D6CYP2C19INPP5D | |
| SCHEMBL4739596 | 0.86 | CYP2D6 (0.71) | CDC25ACDC25BCYP2D6CYP2C19INPP5D | |
| SCHEMBL135273 | 0.86 | CYP2D6 (0.71) | CDC25ACDC25BCYP2D6CYP2C19INPP5D | |
| SCHEMBL28008854 | 0.86 | CYP2D6 (0.71) | CDC25ACDC25BCYP2D6CYP2C19INPP5D | |
| SCHEMBL14676689 | 0.86 | CYP2D6 (0.71) | CDC25ACDC25BCYP2D6CYP2C19INPP5D | |
| SCHEMBL28898907 | 0.86 | CYP2D6 (0.71) | CDC25ACDC25BCYP2D6CYP2C19INPP5D | |
| Water SCHEMBL27578106 | 0.85 | CYP2D6 (0.70) | CDC25ACDC25BCYP2D6CYP2C19INPP5D | |
| Methane SCHEMBL27524872 | 0.85 | CYP2D6 (0.70) | CDC25ACDC25BCYP2D6CYP2C19INPP5D |
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-2023063884-A2 | GENERATION OF CHIRAL SULFINATE ESTERS | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2023-04-20 | — | — | WO | disclosed |