Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 3/20 | 0.45 |
| ▸ | TBK1 | Q9UHD2 | 15/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29470425 | 0.97 | CHEK1 (0.48) | CHEK1KDRTBK1LTA4H | |
| SCHEMBL6125890 | 0.97 | CHEK1 (0.48) | CHEK1KDRTBK1LTA4H | |
| SCHEMBL22201040 | 0.88 | KDR (0.48) | CHEK1KDRTBK1 | |
| SCHEMBL6120082 | 0.87 | KDR (0.48) | KDRTBK1 | |
| SCHEMBL6125747 | 0.87 | KDR (0.51) | CHEK1KDRTBK1 | |
| SCHEMBL29470472 | 0.87 | KDR (0.51) | CHEK1KDRTBK1 | |
| SCHEMBL8739147 | 0.86 | CHEK1 (0.52) | CHEK1KDRTBK1LTA4H | |
| SCHEMBL6125759 | 0.86 | CHEK1 (0.45) | CHEK1TBK1 | |
| SCHEMBL29470551 | 0.86 | CHEK1 (0.45) | CHEK1TBK1 | |
| SCHEMBL29470452 | 0.85 | KDR (0.47) | KDRTBK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2730564-B1 | HETEROCYCLE AMINES AND USES THEREOF | LIGAND PHARM INC (US) | 2018-04-18 | — | — | EP | disclosed |