Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WNT3A | P56704 | 2/20 | 0.54 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.47 |
| ▸ | CDK4 | P11802 | 3/20 | 0.43 |
| ▸ | CDK6 | Q00534 | 3/20 | 0.43 |
| ▸ | QDPR | P09417 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 3/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 1/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
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 SCHEMBL29803488 | 0.93 | WNT3A (0.49) | WNT3AMAPKAPK2CDK4CDK6QDPR | |
| SCHEMBL24670486 | 0.84 | MAPKAPK2 (0.60) | WNT3AMAPKAPK2QDPRSIGMAR1HTR2C | |
| SCHEMBL24267829 | 0.79 | WNT3A (0.59) | WNT3AMAPKAPK2CDK4CDK6QDPR | |
| Hydrochloric Acid SCHEMBL29771347 | 0.78 | WNT3A (0.58) | WNT3AMAPKAPK2CDK4CDK6QDPR | |
| Trifluoroacetic Acid SCHEMBL29803510 | 0.77 | MAPKAPK2 (0.53) | WNT3AMAPKAPK2QDPRSIGMAR1HTR2C | |
| SCHEMBL29803621 | 0.76 | QDPR (0.54) | WNT3ACDK4CDK6QDPRCCNT1 | |
| SCHEMBL29803282 | 0.76 | CCNT1 (0.49) | WNT3AMAPKAPK2CDK4CDK6HTR2C | |
| SCHEMBL24670528 | 0.76 | NAMPT (0.46) | NAMPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL24670537 | 0.75 | MAPKAPK2 (0.45) | MAPKAPK2QDPRSIGMAR1HTR2CNAMPT | |
| SCHEMBL24669887 | 0.74 | MAPKAPK2 (0.48) | MAPKAPK2QDPRSIGMAR1HTR2CNAMPT |
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 |