Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.46 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.44 |
| ▸ | JAK1 | P23458 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 5/20 | 0.42 |
| ▸ | GRM1 | Q13255 | 5/20 | 0.42 |
| ▸ | WNT3A | P56704 | 1/20 | 0.42 |
| ▸ | WDR5 | P61964 | 2/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 3/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.40 |
| ▸ | GABRP | O00591 | 1/20 | 0.40 |
| ▸ | GABRD | O14764 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29803539 | 1.00 | NAMPT (0.46) | NAMPTPDK4JAK1GRM5GRM1 | |
| SCHEMBL24670598 | 0.90 | PDK4 (0.39) | NAMPTPDK4JAK1GRM5GRM1 | |
| SCHEMBL29803459 | 0.86 | MAPKAPK2 (0.36) | NAMPTPDK4JAK1WNT3AWDR5 | |
| SCHEMBL29803696 | 0.85 | NAMPT (0.52) | NAMPTPDK4JAK1GRM5GRM1 | |
| SCHEMBL24669339 | 0.85 | NAMPT (0.52) | NAMPTPDK4JAK1GRM5GRM1 | |
| SCHEMBL24669868 | 0.85 | NAMPT (0.49) | NAMPTPDK4JAK1GRM5GRM1 | |
| SCHEMBL29803286 | 0.85 | NAMPT (0.49) | NAMPTPDK4JAK1GRM5GRM1 | |
| SCHEMBL24669930 | 0.84 | MAPKAPK2 (0.41) | MAPKAPK2 | |
| SCHEMBL29803008 | 0.84 | MAPKAPK2 (0.41) | MAPKAPK2 | |
| SCHEMBL24670946 | 0.82 | NAMPT (0.49) | NAMPTPDK4JAK1GRM5GRM1 |
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 |