Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 4/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 8/20 | 0.39 |
| ▸ | CCND1 | P24385 | 8/20 | 0.39 |
| ▸ | CCND3 | P30281 | 3/20 | 0.39 |
| ▸ | CCND2 | P30279 | 2/20 | 0.39 |
| ▸ | CDK2 | P24941 | 4/20 | 0.38 |
| ▸ | CDK1 | P06493 | 2/20 | 0.38 |
| ▸ | CDK6 | Q00534 | 5/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | GAK | O14976 | 1/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.38 |
| ▸ | FECH | P22830 | 1/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.38 |
| ▸ | CDK16 | Q00536 | 1/20 | 0.38 |
| ▸ | MAP3K1 | Q13233 | 1/20 | 0.38 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.38 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3242367 | 0.92 | LCK (0.48) | BTKLCKJAK3CCND3CDK6 | |
| SCHEMBL3232842 | 0.90 | ROS1 (0.43) | BTKLCKJAK3CDK4CCND1 | |
| SCHEMBL3240119 | 0.82 | LCK (0.48) | BTKLCKJAK3CCND3CDK6 | |
| SCHEMBL29085161 | 0.72 | PRKAA2 (0.51) | — | |
| Hydrochloric Acid SCHEMBL29020742 | 0.72 | PRKAA2 (0.51) | — | |
| SCHEMBL25093041 | 0.71 | PRKAA2 (0.53) | — | |
| SCHEMBL3263746 | 0.71 | LCK (0.40) | BTKLCKJAK3KMT2AMEN1 | |
| SCHEMBL3263743 | 0.71 | LCK (0.40) | BTKLCKJAK3KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL29020773 | 0.70 | PRKAA2 (0.53) | — | |
| SCHEMBL29085246 | 0.67 | HDAC2 (0.49) | — |
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-2010068806-A1 | AMIDE DERIVATIVES AS BTK INHIBITORS IN THE TREATMENT OF ALLERGIC, AUTOIMMUNE AND INFLAMMATORY DISORDERS AS WELL AS CANCER | CGI PHARMACEUTICALS, INC. (US) | 2010-06-17 | — | — | WO | claimed |