Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ULK1 | O75385 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | QDPR | P09417 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | WNT3A | P56704 | 2/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.33 |
| ▸ | CDK9 | P50750 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24671284 | 0.86 | MAPK1 (0.39) | ULK1HRH3QDPRNAMPTCCNT1 | |
| SCHEMBL24669893 | 0.82 | SLC6A3 (0.43) | NAMPTWNT3ASLC6A3KCNH2TAAR1 | |
| SCHEMBL24671230 | 0.82 | NAMPT (0.51) | QDPRNAMPTWNT3ACCNT1CDK9 | |
| SCHEMBL31704847 | 0.82 | CRBN (0.37) | HRH3QDPRNAMPTWNT3ACCNT1 | |
| SCHEMBL31706252 | 0.82 | CRBN (0.37) | HRH3QDPRNAMPTWNT3ACCNT1 | |
| SCHEMBL24670471 | 0.80 | SLC6A3 (0.42) | NAMPTWNT3ASLC6A3KCNH2TAAR1 | |
| Trifluoroacetic Acid SCHEMBL29803405 | 0.76 | PTPN11 (0.47) | ULK1QDPRNAMPTWNT3ASIGMAR1 | |
| Trifluoroacetic Acid SCHEMBL29803567 | 0.75 | SLC6A3 (0.40) | ULK1NAMPTWNT3ASLC6A3KCNH2 | |
| SCHEMBL15001490 | 0.74 | HRH3 (0.42) | HRH3QDPRSIGMAR1ALDH1A1GAA | |
| SCHEMBL15376481 | 0.74 | NAMPT (0.44) | ULK1NAMPT |
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 |