Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 5/20 | 0.63 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.53 |
| ▸ | TMPRSS2 | O15393 | 4/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.44 |
| ▸ | CDK7 | P50613 | 1/20 | 0.44 |
| ▸ | CDK13 | Q14004 | 1/20 | 0.44 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.44 |
| ▸ | GRAMD1A | Q96CP6 | 1/20 | 0.44 |
| ▸ | WNT3A | P56704 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29803436 | 1.00 | NAMPT (0.63) | NAMPTNR1H2TMPRSS2ESR2NPC1 | |
| SCHEMBL24670854 | 0.95 | NAMPT (0.67) | NAMPTNR1H2TMPRSS2ESR2NPC1 | |
| SCHEMBL29803636 | 0.95 | NAMPT (0.67) | NAMPTNR1H2TMPRSS2ESR2NPC1 | |
| SCHEMBL30182726 | 0.94 | NAMPT (0.68) | NAMPTTMPRSS2PIK3CAMTOR | |
| SCHEMBL24892302 | 0.94 | NAMPT (0.68) | NAMPTTMPRSS2PIK3CAMTOR | |
| SCHEMBL29803570 | 0.90 | NAMPT (0.58) | NAMPTNR1H2TMPRSS2ESR2NPC1 | |
| SCHEMBL24670163 | 0.88 | NAMPT (0.51) | NAMPTNR1H2TMPRSS2ESR2NPC1 | |
| SCHEMBL29803391 | 0.88 | NAMPT (0.51) | NAMPTNR1H2TMPRSS2ESR2NPC1 | |
| SCHEMBL24670154 | 0.87 | NAMPT (0.52) | NAMPTNR1H2TMPRSS2ESR2NPC1 | |
| SCHEMBL24669379 | 0.87 | NR1H2 (0.49) | NAMPTNR1H2TMPRSS2ESR2NPC1 |
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 |