Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAK4 | O96013 | 11/20 | 0.58 |
| ▸ | CDK2 | P24941 | 4/20 | 0.58 |
| ▸ | CDK7 | P50613 | 8/20 | 0.51 |
| ▸ | CCNH | P51946 | 8/20 | 0.51 |
| ▸ | MNAT1 | P51948 | 8/20 | 0.51 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.49 |
| ▸ | CDK9 | P50750 | 1/20 | 0.49 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.49 |
| ▸ | MELK | Q14680 | 2/20 | 0.46 |
| ▸ | HIPK4 | Q8NE63 | 1/20 | 0.46 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | RPS6KA1 | Q15418 | 2/20 | 0.42 |
| ▸ | PLK4 | O00444 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | GAK | O14976 | 1/20 | 0.42 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.42 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL25947621 | 0.92 | PAK4 (0.60) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL20754495 | 0.89 | PAK4 (0.60) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL20741115 | 0.85 | CDK7 (0.66) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL31687460 | 0.85 | CDK7 (0.66) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL17878639 | 0.85 | CDK7 (0.66) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL25947627 | 0.84 | PAK4 (0.62) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL25947645 | 0.83 | PAK4 (0.58) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL20741165 | 0.82 | CDK7 (0.73) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL20741163 | 0.82 | CDK7 (0.73) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL22924056 | 0.81 | CDK7 (0.57) | PAK4CDK2CDK7CCNHMNAT1 |
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-2016105528-A2 | INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2016-06-30 | — | — | WO | disclosed |