Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.52 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.43 |
| ▸ | CDK9 | P50750 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPY2R | P49146 | 1/20 | 0.39 |
| ▸ | QDPR | P09417 | 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 | |
|---|---|---|---|---|
| SCHEMBL29803320 | 1.00 | MAPKAPK2 (0.52) | MAPKAPK2CCNT1CDK9ALDH1A1L3MBTL1 | |
| SCHEMBL24669285 | 0.92 | MAPKAPK2 (0.43) | MAPKAPK2CCNT1CDK9ALDH1A1L3MBTL1 | |
| SCHEMBL29803688 | 0.92 | MAPKAPK2 (0.43) | MAPKAPK2CCNT1CDK9ALDH1A1L3MBTL1 | |
| SCHEMBL29803656 | 0.92 | MAPKAPK2 (0.49) | MAPKAPK2CCNT1CDK9ALDH1A1L3MBTL1 | |
| Trifluoroacetic Acid SCHEMBL29803561 | 0.87 | BACE1 (0.41) | MAPKAPK2CCNT1CDK9ALDH1A1L3MBTL1 | |
| SCHEMBL24671575 | 0.86 | MAPT (0.42) | MAPKAPK2CCNT1CDK9ALDH1A1L3MBTL1 | |
| SCHEMBL24669305 | 0.84 | KDM4E (0.48) | MAPKAPK2ALDH1A1L3MBTL1NPC1RAB9A | |
| SCHEMBL24669469 | 0.84 | CCNT1 (0.48) | MAPKAPK2CCNT1CDK9ALDH1A1NAMPT | |
| SCHEMBL24670910 | 0.81 | MAPKAPK2 (0.47) | MAPKAPK2CCNT1CDK9ALDH1A1L3MBTL1 | |
| SCHEMBL29803687 | 0.81 | MAPKAPK2 (0.47) | MAPKAPK2CCNT1CDK9ALDH1A1L3MBTL1 |
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 |