Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QDPR | P09417 | 1/20 | 0.52 |
| ▸ | PLAU | P00749 | 1/20 | 0.49 |
| ▸ | PLAT | P00750 | 1/20 | 0.49 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.48 |
| ▸ | CDK9 | P50750 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.47 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.47 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.46 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.44 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | MELK | Q14680 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29803369 | 0.90 | QDPR (0.49) | QDPRPLAUPLATCCNT1CDK9 | |
| SCHEMBL24892287 | 0.89 | CCNT1 (0.46) | QDPRPLAUPLATCCNT1CDK9 | |
| SCHEMBL29803347 | 0.89 | CCNT1 (0.49) | QDPRPLAUPLATCCNT1CDK9 | |
| SCHEMBL29803803 | 0.88 | MAOB (0.50) | PLAUPLATCCNT1CDK9NPC1 | |
| SCHEMBL29803524 | 0.88 | CCNT1 (0.49) | QDPRPLAUPLATCCNT1CDK9 | |
| SCHEMBL24892288 | 0.88 | KLKB1 (0.45) | PLAUPLATCCNT1CDK9NPC1 | |
| SCHEMBL24669400 | 0.87 | CCNT1 (0.52) | PLAUPLATCCNT1CDK9NPC1 | |
| SCHEMBL29803518 | 0.87 | CCNT1 (0.52) | PLAUPLATCCNT1CDK9NPC1 | |
| SCHEMBL29803227 | 0.87 | QDPR (0.48) | QDPRPLAUPLATCCNT1CDK9 | |
| SCHEMBL24670468 | 0.86 | QDPR (0.44) | QDPRPLAUPLATCCNT1CDK9 |
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 |