Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.30 |
| ▸ | CTSG | P08311 | 1/20 | 0.30 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.30 |
| ▸ | CMA1 | P23946 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20358270 | 0.77 | — | — | |
| SCHEMBL17613516 | 0.77 | ALOX5 (0.33) | KDM4EALDH1A1TDP1ALOX5PRSS1 | |
| SCHEMBL14582347 | 0.76 | ALDH1A1 (0.31) | KDM4EALDH1A1TDP1 | |
| SCHEMBL6908783 | 0.76 | ALDH1A1 (0.30) | ALDH1A1 | |
| Methane SCHEMBL2446533 | 0.75 | ALDH1A1 (0.35) | KDM4EALDH1A1TDP1 | |
| SCHEMBL7992497 | 0.74 | ALDH1A1 (0.33) | KDM4EALDH1A1TDP1 | |
| SCHEMBL30492052 | 0.74 | ALDH1A1 (0.33) | KDM4EALDH1A1TDP1 | |
| SCHEMBL621876 | 0.73 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL13999779 | 0.72 | EPHX1 (0.48) | ALDH1A1 | |
| SCHEMBL931422 | 0.72 | EPHX1 (0.48) | ALDH1A1 |
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-2316829-A1 | Heterocyclic derivatives as modulators of ion channels | Vertex Pharmaceuticals Incorporated (US) | 2011-05-04 | — | — | EP | disclosed |