Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 7/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.34 |
| ▸ | WNT3A | P56704 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29802997 | 0.93 | PTPN11 (0.39) | PTPN11PTPN1ROCK2SLC6A3KCNH2 | |
| SCHEMBL24671076 | 0.84 | PTPN11 (0.38) | PTPN11PTPN1SLC6A3KCNH2TAAR1 | |
| SCHEMBL24670475 | 0.80 | PTPN11 (0.46) | PTPN11PTPN1MAPTNAMPT | |
| Trifluoroacetic Acid SCHEMBL29803396 | 0.80 | TRPV1 (0.38) | PTPN11PTPN1TRPV1EGLN1WNT3A | |
| SCHEMBL24671549 | 0.78 | TP53 (0.40) | PTPN11ROCK2TP53MAPT | |
| SCHEMBL24671535 | 0.77 | TMPRSS2 (0.39) | TRPV1EGLN1TP53MAPTJAK2 | |
| SCHEMBL29803758 | 0.77 | NAMPT (0.48) | WNT3AMAPTNAMPT | |
| SCHEMBL24669641 | 0.76 | EGLN1 (0.41) | EGLN1MAPTJAK2JAK1NAMPT | |
| SCHEMBL24669239 | 0.75 | MMP12 (0.38) | EGLN1TP53MAPTNAMPT | |
| Trifluoroacetic Acid SCHEMBL29803352 | 0.75 | PTPN11 (0.43) | PTPN11PTPN1TRPV1EGLN1MAPT |
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 |