Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.45 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.41 |
| ▸ | CDK9 | P50750 | 3/20 | 0.41 |
| ▸ | MLYCD | O95822 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.39 |
| ▸ | WDR5 | P61964 | 2/20 | 0.39 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL24670266 | 0.85 | CCNT1 (0.52) | NPSR1CCNT1CDK9MLYCDROCK1 | |
| SCHEMBL31702208 | 0.81 | PDE3B (0.47) | PDE3BPDE3ACCNT1CDK9PDK2 | |
| SCHEMBL29803919 | 0.80 | CCNT1 (0.44) | PDE3BPDE3ANPSR1CCNT1CDK9 | |
| SCHEMBL29803888 | 0.78 | CCNT1 (0.46) | PDE3BPDE3ANPSR1CCNT1CDK9 | |
| Trifluoroacetic Acid SCHEMBL29803720 | 0.77 | CCNT1 (0.41) | PDE3BPDE3ANPSR1CCNT1CDK9 | |
| SCHEMBL24670780 | 0.74 | CCNT1 (0.39) | CCNT1CDK9ROCK2ROCK1 | |
| SCHEMBL24670935 | 0.74 | CCNT1 (0.39) | CCNT1CDK9HTR2CBRPF1 | |
| SCHEMBL5536591 | 0.74 | PDE3B (0.52) | PDE3BPDE3AHTR2C | |
| SCHEMBL24671030 | 0.72 | CCNT1 (0.47) | CCNT1CDK9WDR5BRPF1 | |
| SCHEMBL24670925 | 0.72 | CCNT1 (0.41) | CCNT1CDK9ROCK2ROCK1WDR5 |
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 |