Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.37 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22408180 | 0.83 | KMT2A (0.67) | KMT2APKMALDH1A1MEN1GAA | |
| SCHEMBL2188506 | 0.80 | L3MBTL1 (0.45) | KMT2AALDH1A1MEN1GAACYP1A2 | |
| SCHEMBL2188574 | 0.79 | INPPL1 (0.45) | KMT2AALDH1A1MEN1GAACYP1A2 | |
| SCHEMBL2185749 | 0.78 | ALDH1A1 (0.60) | KMT2AALDH1A1MEN1GAACYP1A2 | |
| SCHEMBL2186238 | 0.76 | HPGD (0.61) | KMT2APKMALDH1A1MEN1GAA | |
| SCHEMBL2187828 | 0.76 | KDM4E (0.39) | KMT2AALDH1A1MEN1GAACYP1A2 | |
| SCHEMBL2186717 | 0.75 | MAPT (0.52) | KMT2APKMALDH1A1MEN1GAA | |
| SCHEMBL3370667 | 0.75 | PKM (0.60) | KMT2APKMALDH1A1MEN1GAA | |
| SCHEMBL13964532 | 0.75 | PKM (0.45) | KMT2APKMALDH1A1GAACYP1A2 | |
| SCHEMBL2188707 | 0.74 | ALDH1A1 (0.42) | KMT2AALDH1A1MEN1GAACYP1A2 |
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-1578741-B1 | AROMATIC COMPOUNDS AS ANTI-INFLAMMATORY, IMMUNOMODULATORY AND ANTI-PROLIFERATORY AGENTS | 4SC AG (DE) | 2011-07-13 | — | — | EP | claimed |