Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WNT3A | P56704 | 2/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 4/20 | 0.41 |
| ▸ | CDK9 | P50750 | 4/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | WDR5 | P61964 | 2/20 | 0.39 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 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 | |
|---|---|---|---|---|
| SCHEMBL29803250 | 1.00 | WNT3A (0.44) | WNT3ACCNT1CDK9CHEK1NPC1 | |
| SCHEMBL29803772 | 0.87 | BTK (0.45) | CCNT1CDK9CHEK1WDR5BRPF1 | |
| SCHEMBL29803612 | 0.84 | CCNT1 (0.49) | CCNT1CDK9CHEK1WDR5BRPF1 | |
| SCHEMBL24671109 | 0.84 | CCNT1 (0.49) | CCNT1CDK9CHEK1WDR5BRPF1 | |
| SCHEMBL29803704 | 0.82 | CCNT1 (0.43) | WNT3ACCNT1CDK9WDR5BRPF1 | |
| SCHEMBL24670977 | 0.82 | CCNT1 (0.43) | WNT3ACCNT1CDK9WDR5BRPF1 | |
| SCHEMBL24669407 | 0.81 | WDR5 (0.47) | CCNT1CDK9CHEK1WDR5BRPF1 | |
| SCHEMBL29803489 | 0.81 | WDR5 (0.47) | CCNT1CDK9CHEK1WDR5BRPF1 | |
| SCHEMBL29803370 | 0.81 | CCNT1 (0.49) | CCNT1CDK9NPC1WDR5BRPF1 | |
| Trifluoroacetic Acid SCHEMBL29803381 | 0.79 | CCNT1 (0.45) | CCNT1CDK9WDR5BRPF1BTK |
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 |