Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK8 | P49336 | 2/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | AXL | P30530 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 2/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 1/20 | 0.31 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.31 |
| ▸ | CCR4 | P51679 | 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 | |
|---|---|---|---|---|
| SCHEMBL13604904 | 0.77 | CDK8 (0.39) | CDK8FGFR1KDRAXLPIK3CD | |
| SCHEMBL12146427 | 0.77 | CDK8 (0.36) | CDK8FGFR1KDRAXLPIK3CD | |
| SCHEMBL24005537 | 0.76 | PIK3CA (0.37) | CDK8FGFR1KDRAXLPIK3CD | |
| SCHEMBL24005526 | 0.76 | CDK8 (0.35) | CDK8FGFR1KDRAXLPIK3CD | |
| SCHEMBL25624524 | 0.73 | CDK8 (0.34) | CDK8FGFR1KDRAXLPIK3CD | |
| SCHEMBL16982068 | 0.73 | FEN1 (0.36) | CDK8FGFR1KDRAXLPIK3CD | |
| SCHEMBL25650900 | 0.70 | LPAR1 (0.33) | CDK8FGFR1KDRAXLBRD4 | |
| SCHEMBL25650901 | 0.69 | CDK8 (0.44) | CDK8FGFR1KDRBRD4 | |
| SCHEMBL25613029 | 0.68 | FEN1 (0.39) | CDK8FGFR1KDRAXLPIK3CD | |
| SCHEMBL24005755 | 0.68 | CDK8 (0.36) | CDK8PIK3CAKDM5BFEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9765030-B2 | Benzylamine derivatives and their utility as cholesterol ester-transfer protein inhibitors | DR. REDDY'S LABORATORIES LTD. (IN) | 2017-09-19 | — | — | US | disclosed |