Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20111730 | 0.91 | SMYD3 (0.30) | SMYD3 | |
| SCHEMBL20111634 | 0.79 | SMYD3 (0.31) | PIK3CAJAK2JAK1SMYD3 | |
| SCHEMBL20111628 | 0.78 | MCOLN3 (0.40) | PIK3CAJAK2JAK1 | |
| SCHEMBL20008977 | 0.72 | HSD11B1 (0.34) | SMYD3 | |
| SCHEMBL24261284 | 0.71 | PIK3CA (0.35) | PIK3CAJAK2JAK1 | |
| SCHEMBL20711788 | 0.71 | PIK3CA (0.35) | PIK3CAJAK2JAK1 | |
| SCHEMBL12206044 | 0.71 | PIK3CA (0.35) | PIK3CAJAK2JAK1 | |
| SCHEMBL20111633 | 0.71 | PIK3CA (0.32) | PIK3CAJAK2JAK1 | |
| SCHEMBL20609751 | 0.70 | PIK3CA (0.37) | PIK3CAJAK2JAK1 | |
| SCHEMBL19369412 | 0.69 | TP53 (0.41) | — |
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-2018078360-A1 | MODULATORS OF HEDGEHOG (HH) SIGNALLING PATHWAY | E-THERAPEUTICS PLC (GB) | 2018-05-03 | — | — | WO | disclosed |