Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.49 |
| ▸ | RELA | Q04206 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.48 |
| ▸ | TNFRSF1A | P19438 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30834905 | 0.84 | NFKB1 (0.53) | MAPTNPSR1KMT2AMEN1KCNA3 | |
| Xanthohumol B SCHEMBL29934961 | 0.77 | NFKB1 (0.56) | MAPTNPSR1NFKB1NFKB2RELA | |
| Xanthohumol B SCHEMBL12961703 | 0.77 | NFKB1 (0.56) | MAPTNPSR1NFKB1NFKB2RELA | |
| SCHEMBL5997891 | 0.76 | MAOB (0.52) | MAPTKMT2AMEN1NFKB1NFKB2 | |
| SCHEMBL14523845 | 0.76 | MAOB (0.52) | MAPTKMT2AMEN1NFKB1NFKB2 | |
| SCHEMBL18741310 | 0.70 | MAPT (0.71) | MAPTNPSR1KMT2AMEN1KCNA3 | |
| SCHEMBL18741311 | 0.70 | MAPT (0.71) | MAPTNPSR1KMT2AMEN1KCNA3 | |
| SCHEMBL12485774 | 0.70 | ABCG2 (0.85) | MAPTNPSR1KMT2AMEN1KCNA3 | |
| SCHEMBL25203549 | 0.70 | MAPT (0.86) | MAPTNPSR1KMT2AMEN1KCNA3 | |
| SCHEMBL12485779 | 0.70 | ABCG2 (0.85) | MAPTNPSR1KMT2AMEN1KCNA3 |
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-2810198-B1 | ANTI-INVASIVE COMPOUNDS | UNIV GENT (BE) | 2023-07-12 | — | — | EP | disclosed |