Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.66 |
| ▸ | MAPT | P10636 | 7/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.66 |
| ▸ | TP53 | P04637 | 6/20 | 0.66 |
| ▸ | RAB9A | P51151 | 5/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.66 |
| ▸ | MEN1 | O00255 | 5/20 | 0.66 |
| ▸ | NPC1 | O15118 | 4/20 | 0.66 |
| ▸ | HPGD | P15428 | 4/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.66 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.66 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.66 |
| ▸ | RELA | Q04206 | 2/20 | 0.66 |
| ▸ | MAOA | P21397 | 2/20 | 0.66 |
| ▸ | MAOB | P27338 | 2/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL18222927 | 1.00 | ALDH1A1 (0.66) | ALDH1A1CYP3A4KDM4ESMN1; SMN2MAPT | |
| SCHEMBL18222886 | 0.91 | ALDH1A1 (0.65) | ALDH1A1CYP3A4KDM4ESMN1; SMN2MAPT | |
| SCHEMBL30903609 | 0.91 | ALDH1A1 (0.65) | ALDH1A1CYP3A4KDM4ESMN1; SMN2MAPT | |
| SCHEMBL18222910 | 0.87 | CYP3A4 (0.60) | ALDH1A1CYP3A4KDM4ESMN1; SMN2MAPT | |
| SCHEMBL30903590 | 0.84 | ALOX15 (0.69) | ALDH1A1CYP3A4KDM4ESMN1; SMN2MAPT | |
| SCHEMBL18222903 | 0.84 | ALOX15 (0.69) | ALDH1A1CYP3A4KDM4ESMN1; SMN2MAPT | |
| SCHEMBL28469105 | 0.84 | ALDH1A1 (0.67) | ALDH1A1CYP3A4KDM4ESMN1; SMN2MAPT | |
| SCHEMBL18222917 | 0.82 | ALDH1A1 (0.72) | ALDH1A1CYP3A4KDM4ESMN1; SMN2MAPT | |
| SCHEMBL30903585 | 0.82 | ALDH1A1 (0.72) | ALDH1A1CYP3A4KDM4ESMN1; SMN2MAPT | |
| SCHEMBL26145339 | 0.81 | KDM4E (0.85) | ALDH1A1CYP3A4KDM4ESMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-113185486-B | Antitumor agent 3-aryl-4H-chromen-4-one for the treatment of cancer | 肯塔基大学研究基金会 | 2024-05-10 | — | — | CN | disclosed |