Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE1 | P42892 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16886886 | 0.79 | ECE1 (0.40) | ECE1CA2CA1 | |
| SCHEMBL7357154 | 0.79 | ECE1 (0.40) | ECE1CA2CA1 | |
| SCHEMBL7357150 | 0.79 | ECE1 (0.40) | ECE1CA2CA1 | |
| SCHEMBL2200386 | 0.76 | ECE1 (0.38) | ECE1CA2CA1 | |
| SCHEMBL2200376 | 0.76 | ECE1 (0.38) | ECE1CA2CA1 | |
| SCHEMBL19901361 | 0.76 | ECE1 (0.41) | ECE1CA2CA1 | |
| SCHEMBL19901362 | 0.76 | ECE1 (0.41) | ECE1CA2CA1 | |
| SCHEMBL19901363 | 0.76 | ECE1 (0.41) | ECE1CA2CA1 | |
| SCHEMBL15131285 | 0.72 | ECE1 (0.41) | ECE1 | |
| SCHEMBL7248592 | 0.72 | CA1 (0.37) | CA2CA1ALDH1A1 |
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-2004014882-A2 | PROTEASOME INHIBITORS : PEPTIDE DERIVATIVES HAVING C-TERMINAL HETEROARYL GROUPS | AXYS PHARMACEUTICALS (US) | 2004-02-19 | — | — | WO | disclosed |