Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.47 |
| ▸ | NAMPT | P43490 | 4/20 | 0.44 |
| ▸ | QDPR | P09417 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | CFTR | P13569 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24891773 | 0.91 | NAMPT (0.48) | HDAC1NAMPTQDPRHDAC6ALDH1A1 | |
| SCHEMBL24891939 | 0.82 | NAMPT (0.38) | HDAC1NAMPTQDPRHDAC6ALDH1A1 | |
| SCHEMBL24670226 | 0.80 | NAMPT (0.57) | HDAC1NAMPTHDAC6MAPTCD274 | |
| SCHEMBL24892276 | 0.80 | NAMPT (0.57) | HDAC1NAMPTHDAC6MAPTCD274 | |
| SCHEMBL24891656 | 0.79 | NAMPT (0.53) | HDAC1NAMPTHDAC6ALDH1A1KDM4E | |
| SCHEMBL24891726 | 0.79 | ALDH1A1 (0.43) | HDAC1NAMPTQDPRALDH1A1HPGD | |
| SCHEMBL24891842 | 0.78 | NAMPT (0.45) | HDAC1NAMPTHDAC6MAPT | |
| SCHEMBL24891980 | 0.76 | NAMPT (0.52) | HDAC1NAMPTHDAC6MAPTCD274 | |
| SCHEMBL24892051 | 0.75 | NAMPT (0.53) | HDAC1NAMPTHDAC6MAPT | |
| SCHEMBL30182051 | 0.75 | NAMPT (0.53) | HDAC1NAMPTHDAC6MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023287736-A1 | NOVEL BIS-AMIDE CONTAINING COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2023-01-19 | — | — | WO | disclosed |