Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK7 | P50613 | 14/20 | 0.61 |
| ▸ | CCNT1 | O60563 | 11/20 | 0.61 |
| ▸ | CDK9 | P50750 | 11/20 | 0.61 |
| ▸ | CCNH | P51946 | 11/20 | 0.61 |
| ▸ | CCNK | O75909 | 10/20 | 0.61 |
| ▸ | CDK12 | Q9NYV4 | 10/20 | 0.61 |
| ▸ | MNAT1 | P51948 | 8/20 | 0.61 |
| ▸ | CDK2 | P24941 | 11/20 | 0.57 |
| ▸ | CDK13 | Q14004 | 7/20 | 0.57 |
| ▸ | CCNA2 | P20248 | 6/20 | 0.57 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.57 |
| ▸ | JUN | P05412 | 5/20 | 0.55 |
| ▸ | MAPK8 | P45983 | 5/20 | 0.55 |
| ▸ | MAPK9 | P45984 | 5/20 | 0.55 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL17150705 | 0.87 | CDK7 (0.81) | CDK7CCNT1CDK9CCNHCCNK | |
| SCHEMBL22778393 | 0.87 | CDK7 (0.77) | CDK7CCNT1CDK9CCNHCCNK | |
| SCHEMBL17696263 | 0.87 | CDK7 (0.77) | CDK7CCNT1CDK9CCNHCCNK | |
| SCHEMBL19024596 | 0.86 | CDK7 (0.72) | CDK7CCNT1CDK9CCNHCCNK | |
| SCHEMBL17151963 | 0.84 | CDK7 (0.57) | CDK7CCNT1CDK9CCNHCCNK | |
| SCHEMBL17151936 | 0.81 | CDK7 (0.64) | CDK7CCNT1CDK9CCNHCCNK | |
| SCHEMBL18078644 | 0.81 | CDK2 (0.68) | CDK7CCNT1CDK9CCNHCCNK | |
| SCHEMBL19054626 | 0.80 | CDK7 (0.65) | CDK7CCNT1CDK9CCNHCCNK | |
| SCHEMBL17150423 | 0.79 | CDK7 (0.59) | CDK7CCNT1CDK9CCNHCCNK | |
| SCHEMBL19024546 | 0.79 | CDK7 (0.76) | CDK7CCNT1CDK9CCNHCCNK |
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-2019035866-A1 | COMPOSITIONS AND METHODS FOR TREATING TUBEROUS SCLEROSIS COMPLEX | THE BRIGHAM & WOMEN'S HOSPITAL, INC. (US) | 2019-02-21 | — | — | WO | disclosed |