Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | QDPR | P09417 | 2/20 | 0.35 |
| ▸ | CSF1R | P07333 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | HTR6 | P50406 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 6/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
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 SCHEMBL29803316 | 0.94 | MAPKAPK2 (0.41) | MAPKAPK2NAMPTQDPRCSF1RSIGMAR1 | |
| SCHEMBL24669887 | 0.86 | MAPKAPK2 (0.48) | MAPKAPK2NAMPTQDPRCSF1RSIGMAR1 | |
| SCHEMBL24670486 | 0.85 | MAPKAPK2 (0.60) | MAPKAPK2NAMPTQDPRCSF1RSIGMAR1 | |
| Trifluoroacetic Acid SCHEMBL29803620 | 0.81 | MAPKAPK2 (0.43) | MAPKAPK2NAMPTCSF1RSIGMAR1HTR6 | |
| Trifluoroacetic Acid SCHEMBL29803510 | 0.81 | MAPKAPK2 (0.53) | MAPKAPK2NAMPTQDPRCSF1RSIGMAR1 | |
| SCHEMBL24669213 | 0.77 | MAPKAPK2 (0.49) | MAPKAPK2NAMPTCSF1RALDH1A1RAB9A | |
| SCHEMBL29803746 | 0.76 | CCNT1 (0.42) | MAPKAPK2NAMPTQDPRSIGMAR1HTR6 | |
| SCHEMBL24669855 | 0.75 | MAPT (0.37) | NAMPTALDH1A1RAB9A | |
| SCHEMBL24671307 | 0.75 | WNT3A (0.54) | MAPKAPK2NAMPTQDPRCSF1RSIGMAR1 | |
| SCHEMBL29803435 | 0.75 | MAPKAPK2 (0.47) | MAPKAPK2NAMPTQDPRSIGMAR1HTR2C |
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 |