Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 9/20 | 0.56 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24670465 | 0.93 | MAPKAPK2 (0.64) | MAPKAPK2LMNAIRAK4PTPN1MAPT | |
| SCHEMBL24670344 | 0.85 | MAPKAPK2 (0.66) | MAPKAPK2IRAK4PTPN1MAPTNAMPT | |
| Trifluoroacetic Acid SCHEMBL29803556 | 0.84 | MAPKAPK2 (0.53) | MAPKAPK2LMNAALDH1A1POLBGAA | |
| Trifluoroacetic Acid SCHEMBL29803567 | 0.79 | SLC6A3 (0.40) | MAPKAPK2PTPN1NAMPTSLC2A1PTPN11 | |
| SCHEMBL24669274 | 0.77 | MAPKAPK2 (0.59) | MAPKAPK2LMNAALDH1A1POLBGAA | |
| SCHEMBL29803788 | 0.76 | MAPKAPK2 (0.54) | MAPKAPK2LMNAPOLBTDP1NAMPT | |
| Trifluoroacetic Acid SCHEMBL29803632 | 0.76 | TP53 (0.39) | MAPKAPK2MAPTNAMPTPTPN11SMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL29803290 | 0.75 | MAPKAPK2 (0.45) | MAPKAPK2NAMPTSLC2A1 | |
| Trifluoroacetic Acid SCHEMBL29803447 | 0.74 | MAPKAPK2 (0.41) | MAPKAPK2SLC2A1 | |
| SCHEMBL29803401 | 0.73 | CCNT1 (0.45) | MAPKAPK2NAMPT |
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-2022192162-A1 | NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2022-09-15 | — | — | WO | disclosed |