Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.52 |
| ▸ | NAMPT | P43490 | 1/20 | 0.51 |
| ▸ | QDPR | P09417 | 3/20 | 0.46 |
| ▸ | ULK1 | O75385 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 6/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | WNT3A | P56704 | 2/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 SCHEMBL29803754 | 0.92 | MAPKAPK2 (0.46) | MAPKAPK2NAMPTQDPRULK1HTR2C | |
| Hydrochloric Acid SCHEMBL29803477 | 0.89 | MAPKAPK2 (0.48) | MAPKAPK2NAMPTULK1HTR2CWNT3A | |
| SCHEMBL24670454 | 0.88 | MAPKAPK2 (0.47) | MAPKAPK2NAMPTQDPRULK1HTR2C | |
| SCHEMBL24670483 | 0.87 | ULK1 (0.41) | MAPKAPK2NAMPTQDPRULK1HTR2C | |
| SCHEMBL24670468 | 0.84 | QDPR (0.44) | MAPKAPK2NAMPTQDPRULK1MEN1 | |
| Trifluoroacetic Acid SCHEMBL29803719 | 0.82 | ULK1 (0.42) | MAPKAPK2NAMPTULK1HTR2CSIGMAR1 | |
| SCHEMBL29803733 | 0.80 | MAPKAPK2 (0.52) | MAPKAPK2NAMPTQDPRHTR2CSIGMAR1 | |
| SCHEMBL24670573 | 0.80 | MAPKAPK2 (0.59) | MAPKAPK2NAMPTQDPRHTR2CSIGMAR1 | |
| Trifluoroacetic Acid SCHEMBL29803428 | 0.79 | ULK1 (0.40) | MAPKAPK2NAMPTQDPRULK1MAPT | |
| Trifluoroacetic Acid SCHEMBL29803693 | 0.79 | HDAC1 (0.51) | MAPKAPK2NAMPTULK1 |
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 |