Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | XIAP | P98170 | 1/20 | 0.41 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NAAA | Q02083 | 5/20 | 0.40 |
| ▸ | FAAH | O00519 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ACE | P12821 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10442245 | 0.88 | KDM4E (0.50) | KDM4EALDH1A1ALOX15TSHRXIAP | |
| SCHEMBL30252357 | 0.85 | KDM4E (0.48) | KDM4EALDH1A1ALOX15TSHRXIAP | |
| SCHEMBL8151147 | 0.85 | KDM4E (0.48) | KDM4EALDH1A1ALOX15TSHRXIAP | |
| SCHEMBL23904643 | 0.76 | CYP3A4 (0.60) | KDM4EALDH1A1ALOX15TSHRXIAP | |
| SCHEMBL9575065 | 0.75 | KDM4E (0.47) | KDM4EHSD17B10TDP1NAAAFAAH | |
| SCHEMBL10299130 | 0.74 | CYP3A4 (0.51) | KDM4EALDH1A1ALOX15TSHRXIAP | |
| SCHEMBL12174899 | 0.73 | ALDH1A1 (0.68) | ALDH1A1TSHRL3MBTL1LMNAGAA | |
| SCHEMBL8919299 | 0.73 | ALDH1A1 (0.68) | ALDH1A1TSHRL3MBTL1LMNAGAA | |
| SCHEMBL15792768 | 0.73 | KDM4E (0.55) | KDM4ETSHRNAAAFAAHCYP3A4 | |
| SCHEMBL13293227 | 0.72 | KDM4E (0.50) | KDM4ENAAAFAAH |
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-2004037784-A2 | PYRROLIDONES WITH ANTI-HIV ACTIVITY | IRM LLC (BM) | 2004-05-06 | — | — | WO | disclosed |