Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 3/20 | 0.70 |
| ▸ | MMP3 | P08254 | 2/20 | 0.70 |
| ▸ | MMP9 | P14780 | 2/20 | 0.70 |
| ▸ | PARP1 | P09874 | 3/20 | 0.64 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 6/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.62 |
| ▸ | THRB | P10828 | 3/20 | 0.62 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.61 |
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.60 |
| ▸ | MAPT | P10636 | 5/20 | 0.60 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.60 |
| ▸ | TP53 | P04637 | 4/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.60 |
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 | |
|---|---|---|---|---|
| Robustaflavone SCHEMBL561807 | 0.92 | APP (0.77) | APPMMP3MMP9PARP1PARP2 | |
| Robustaflavone SCHEMBL7643511 | 0.91 | APP (0.76) | APPMMP3MMP9PARP1PARP2 | |
| Robustaflavone SCHEMBL7638211 | 0.91 | APP (0.76) | APPMMP3MMP9PARP1PARP2 | |
| SCHEMBL17166013 | 0.89 | APP (0.89) | APPMMP3MMP9PARP1PARP2 | |
| Robustaflavone SCHEMBL624405 | 0.87 | APP (0.69) | APPMMP3MMP9PARP1PARP2 | |
| SCHEMBL12636897 | 0.85 | CYP1B1 (0.81) | APPMMP3MMP9PARP1PARP2 | |
| Robustaflavone SCHEMBL7454193 | 0.83 | KMT2A (0.66) | APPMMP3MMP9PARP1PARP2 | |
| SCHEMBL25858984 | 0.83 | CBS (0.73) | APPMMP3MMP9PARP1PARP2 | |
| SCHEMBL27198460 | 0.83 | POLH (0.73) | APPMMP3MMP9PARP1PARP2 | |
| Robustaflavone SCHEMBL7517639 | 0.83 | APP (0.67) | APPMMP3MMP9PARP1PARP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9155792-B2 | RecA inhibitors with antibiotic activity, compositions and methods of use | TRUSTEES OF BOSTON UNIVERSITY (US) | 2015-10-13 | — | — | US | disclosed |