Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAK4 | O96013 | 16/20 | 0.80 |
| ▸ | CDK2 | P24941 | 2/20 | 0.80 |
| ▸ | CDK7 | P50613 | 5/20 | 0.71 |
| ▸ | CCNH | P51946 | 5/20 | 0.71 |
| ▸ | MNAT1 | P51948 | 5/20 | 0.71 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.68 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.68 |
| ▸ | CDK9 | P50750 | 1/20 | 0.68 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.68 |
| ▸ | PLK4 | O00444 | 1/20 | 0.67 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.67 |
| ▸ | AURKA | O14965 | 1/20 | 0.67 |
| ▸ | GAK | O14976 | 1/20 | 0.67 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.67 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.67 |
| ▸ | STK16 | O75716 | 1/20 | 0.67 |
| ▸ | PAK3 | O75914 | 1/20 | 0.67 |
| ▸ | CDKL5 | O76039 | 1/20 | 0.67 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.67 |
| ▸ | LATS1 | O95835 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL1205125 | 0.91 | PAK4 (0.83) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL19312151 | 0.90 | PAK4 (0.66) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL25125710 | 0.90 | PAK4 (0.76) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL1205139 | 0.89 | PAK4 (1.00) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL23837237 | 0.88 | PAK4 (0.63) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL1368935 | 0.87 | PAK4 (0.73) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL23837263 | 0.87 | PAK4 (0.62) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL28713458 | 0.87 | PAK4 (0.92) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL28720438 | 0.87 | PAK4 (0.92) | PAK4CDK2CDK7CCNHMNAT1 | |
| SCHEMBL23837262 | 0.86 | PAK4 (0.61) | 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-2021133601-A1 | THE COMBINATION OF CYCLIN DEPENDENT KINASE 7 INHIBITOR AND IMMUNOTHERAPY FOR TREATMENT OF CANCER | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2021-07-01 | — | — | WO | disclosed |