Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 2/20 | 0.35 |
| ▸ | CCNK | O75909 | 2/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.35 |
| ▸ | CDK2 | P24941 | 2/20 | 0.35 |
| ▸ | CDK7 | P50613 | 2/20 | 0.35 |
| ▸ | CDK9 | P50750 | 2/20 | 0.35 |
| ▸ | CCNH | P51946 | 2/20 | 0.35 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MLYCD | O95822 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 5/20 | 0.32 |
| ▸ | AURKB | Q96GD4 | 5/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21188508 | 0.74 | BRD4 (0.39) | MAPK1MLYCDAURKAAURKBBRD4 | |
| SCHEMBL21188547 | 0.69 | CCNK (0.45) | CCNT1CCNKCCNE1CDK2CDK7 | |
| SCHEMBL21184377 | 0.69 | CCNK (0.65) | CCNT1CCNKCCNE1CDK2CDK7 | |
| SCHEMBL17875696 | 0.66 | BRD4 (0.44) | MAPK1BRD4USP2CYP1A2CYP3A4 | |
| SCHEMBL21188481 | 0.64 | BRD4 (0.44) | AURKAAURKBBRD4USP2CYP1A2 | |
| SCHEMBL30522617 | 0.61 | BRD4 (0.46) | MAPK1BRD4USP2CYP1A2CYP3A4 | |
| SCHEMBL5019496 | 0.61 | KDM4E (0.44) | — | |
| SCHEMBL31125220 | 0.61 | KDM4E (0.44) | — | |
| SCHEMBL21184546 | 0.60 | CCNK (0.64) | CCNT1CCNKCCNE1CDK2CDK7 | |
| SCHEMBL18319367 | 0.59 | ERN1 (0.43) | AURKAAURKBBRD4CYP1A2 |
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-2019143719-A1 | INHIBITORS OF CYCLIN-DEPENDENT KINASE 7 (CDK7) | SYROS PHARMACEUTICALS, INC. (US) | 2019-07-25 | — | — | WO | disclosed |