Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 4/20 | 0.42 |
| ▸ | CSF1R | P07333 | 1/20 | 0.42 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.40 |
| ▸ | QDPR | P09417 | 2/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.38 |
| ▸ | CDK9 | P50750 | 2/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.37 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL29803302 | 0.94 | FTO (0.39) | HTR2CCSF1RFTOSIGMAR1MAPKAPK2 | |
| SCHEMBL29803753 | 0.84 | CCNT1 (0.45) | HTR2CCSF1RFTOSIGMAR1MAPKAPK2 | |
| SCHEMBL29803327 | 0.80 | NPC1 (0.52) | MAPKAPK2SLC2A1 | |
| Trifluoroacetic Acid SCHEMBL29803811 | 0.79 | CCNT1 (0.42) | HTR2CFTOSIGMAR1MAPKAPK2QDPR | |
| Hydrochloric Acid SCHEMBL2827994 | 0.78 | HDAC1 (0.54) | HTR2CSIGMAR1QDPRNAMPTHDAC2 | |
| SCHEMBL29803364 | 0.78 | QDPR (0.42) | HTR2CCSF1RMAPKAPK2QDPRNAMPT | |
| SCHEMBL29802854 | 0.78 | TMPRSS2 (0.43) | SIGMAR1QDPRNAMPTHDAC2HDAC1 | |
| SCHEMBL24670994 | 0.78 | TMPRSS2 (0.43) | SIGMAR1QDPRNAMPTHDAC2HDAC1 | |
| SCHEMBL24669304 | 0.78 | CCNT1 (0.47) | HTR2CCSF1RQDPRNAMPTCCNT1 | |
| SCHEMBL29803667 | 0.78 | CCNT1 (0.47) | HTR2CCSF1RQDPRNAMPTCCNT1 |
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 |