Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | CCND3 | P30281 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.37 |
| ▸ | AXL | P30530 | 8/20 | 0.36 |
| ▸ | BCL6 | P41182 | 2/20 | 0.35 |
| ▸ | SIK1 | P57059 | 1/20 | 0.34 |
| ▸ | SIK2 | Q9H0K1 | 1/20 | 0.34 |
| ▸ | SIK3 | Q9Y2K2 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.34 |
| ▸ | IDH2 | P48735 | 1/20 | 0.33 |
| ▸ | INSR | P06213 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4838644 | 0.88 | IDH2 (0.40) | EGFRCCNT1CDK4CCND1CCND3 | |
| SCHEMBL5032511 | 0.82 | RAB9A (0.39) | IDH2 | |
| SCHEMBL5032373 | 0.80 | SMN1; SMN2 (0.39) | BCL6MAPK8 | |
| SCHEMBL14268424 | 0.80 | EGFR (0.40) | EGFRAXLBCL6 | |
| SCHEMBL4870097 | 0.79 | BCL6 (0.42) | EGFRCCND3CDK6AXLBCL6 | |
| SCHEMBL4837995 | 0.79 | IDH2 (0.42) | EGFRAXLBCL6SIK1SIK2 | |
| SCHEMBL5032431 | 0.78 | NPSR1 (0.38) | CDK4CCND1BCL6 | |
| SCHEMBL4832236 | 0.78 | IDH2 (0.43) | EGFRCCNT1CDK4CCND1CCND3 | |
| SCHEMBL4836907 | 0.77 | GALR1 (0.40) | EGFRAXLBCL6 | |
| SCHEMBL4832431 | 0.76 | IDH2 (0.44) | EGFRCCNT1CDK4CCND1CCND3 |
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-7335656-B2 | Stent with a disposed traiazine compound such as 6-(3-Chloro-4-methoxy-phenoxy)-N-cycloheptyl-N'-methyl-N'-(1-methyl-piperidin-4-yl)-[1,3,5]triazine-2,4-diamine for inhibiting smooth muscle proliferation; restenosis and atherosclerosis | REDDY US THERAPEUTICS, INC. (US) | 2008-02-26 | — | — | US | disclosed |