Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 1/20 | 0.50 |
| ▸ | CDK9 | P50750 | 1/20 | 0.50 |
| ▸ | QDPR | P09417 | 3/20 | 0.47 |
| ▸ | HTR2C | P28335 | 6/20 | 0.44 |
| ▸ | CSF1R | P07333 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.42 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29803677 | 1.00 | CCNT1 (0.50) | CCNT1CDK9QDPRHTR2CCSF1R | |
| Trifluoroacetic Acid SCHEMBL29803958 | 0.93 | CCNT1 (0.46) | CCNT1CDK9QDPRHTR2CCSF1R | |
| SCHEMBL29223059 | 0.85 | CCNT1 (0.65) | CCNT1CDK9QDPRHTR2CNAMPT | |
| SCHEMBL29803612 | 0.85 | CCNT1 (0.49) | CCNT1CDK9QDPRHTR2CCSF1R | |
| SCHEMBL24671109 | 0.85 | CCNT1 (0.49) | CCNT1CDK9QDPRHTR2CCSF1R | |
| SCHEMBL24669469 | 0.83 | CCNT1 (0.48) | CCNT1CDK9QDPRHTR2CNAMPT | |
| SCHEMBL24671113 | 0.82 | TP53 (0.49) | CCNT1CDK9QDPRHTR2CCSF1R | |
| SCHEMBL29803912 | 0.82 | TP53 (0.49) | CCNT1CDK9QDPRHTR2CCSF1R | |
| SCHEMBL29803546 | 0.81 | QDPR (0.47) | CCNT1CDK9QDPRHTR2CCSF1R | |
| SCHEMBL29803527 | 0.80 | MAPKAPK2 (0.49) | CCNT1CDK9QDPRHTR2CNAMPT |
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 |