Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 4/20 | 0.64 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.64 |
| ▸ | ALOX15 | P16050 | 6/20 | 0.61 |
| ▸ | ALOX12 | P18054 | 5/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.60 |
| ▸ | MAOA | P21397 | 5/20 | 0.60 |
| ▸ | MAOB | P27338 | 5/20 | 0.60 |
| ▸ | NPC1 | O15118 | 4/20 | 0.60 |
| ▸ | RAB9A | P51151 | 4/20 | 0.60 |
| ▸ | HPGD | P15428 | 4/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.60 |
| ▸ | ESR1 | P03372 | 3/20 | 0.60 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.60 |
| ▸ | TP53 | P04637 | 3/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.60 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | TTR | P02766 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27803898 | 0.89 | ALOX15 (0.62) | XDHPFKFB3ALOX15ALOX12ALDH1A1 | |
| SCHEMBL17166268 | 0.84 | ALDH2 (0.64) | XDHPFKFB3ALOX15ALOX12ALDH1A1 | |
| SCHEMBL28437800 | 0.83 | XDH (0.71) | XDHPFKFB3ALOX15ALOX12ALDH1A1 | |
| SCHEMBL6180056 | 0.80 | XDH (0.62) | XDHPFKFB3ALOX15ALOX12ALDH1A1 | |
| SCHEMBL30533224 | 0.78 | XDH (1.00) | XDHPFKFB3ALOX15ALOX12ALDH1A1 | |
| SCHEMBL571127 | 0.78 | XDH (1.00) | XDHPFKFB3ALOX15ALOX12ALDH1A1 | |
| SCHEMBL26071480 | 0.77 | ALDH1A1 (0.66) | XDHPFKFB3ALOX15ALOX12ALDH1A1 | |
| SCHEMBL73999 | 0.76 | ALOX12 (1.00) | XDHPFKFB3ALOX15ALOX12ALDH1A1 | |
| SCHEMBL29772934 | 0.76 | ALOX12 (1.00) | XDHPFKFB3ALOX15ALOX12ALDH1A1 | |
| SCHEMBL131524 | 0.76 | XDH (0.74) | XDHPFKFB3ALOX15ALOX12ALDH1A1 |
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 |