Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AXL | P30530 | 4/20 | 0.66 |
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.62 |
| ▸ | KIT | P10721 | 2/20 | 0.52 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.51 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.50 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.50 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.50 |
| ▸ | CDK2 | P24941 | 1/20 | 0.50 |
| ▸ | CDK9 | P50750 | 1/20 | 0.50 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.49 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.48 |
| ▸ | SGK1 | O00141 | 1/20 | 0.47 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL20732953 | 0.85 | AAK1 (0.53) | AXLAAK1KITPIK3CANTRK1 | |
| SCHEMBL20733101 | 0.84 | AXL (0.60) | AXLAAK1KITPIK3CANTRK1 | |
| SCHEMBL20732813 | 0.83 | AXL (0.51) | AXLAAK1KITNTRK1NEK1 | |
| SCHEMBL20733095 | 0.83 | AAK1 (0.66) | AXLAAK1KITPIK3CANTRK1 | |
| SCHEMBL857686 | 0.81 | AAK1 (0.56) | AXLAAK1NTRK1NEK1DYRK1A | |
| SCHEMBL415002 | 0.81 | AXL (0.69) | AXLAAK1KITNTRK1NEK1 | |
| SCHEMBL412853 | 0.80 | NEK1 (0.58) | AXLAAK1KITNTRK1NEK1 | |
| SCHEMBL411355 | 0.79 | NPSR1 (0.53) | AXLAAK1NTRK1DYRK1ABRD4 | |
| SCHEMBL858329 | 0.79 | AAK1 (0.67) | AXLAAK1KITNTRK1CDK2 | |
| SCHEMBL20732957 | 0.79 | AAK1 (0.53) | AXLAAK1NTRK1NEK1DYRK1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3666770-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS CDK8/19 INHIBITORS | Joint Stock Company "Biocad" (RU) | 2020-06-17 | — | — | EP | claimed |
| EP-3666770-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS CDK8/19 INHIBITORS | Joint Stock Company "Biocad" (RU) | 2020-06-17 | — | — | EP | disclosed |
| WO-2019031990-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS CDK8/19 INHIBITORS | ЗАКРЫТОЕ АКЦИОНЕРНОЕ ОБЩЕСТВО "БИОКАД" | 2019-02-14 | — | — | WO | disclosed |