Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.51 |
| ▸ | BTK | Q06187 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 2/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.40 |
| ▸ | AKT1 | P31749 | 4/20 | 0.40 |
| ▸ | AKT2 | P31751 | 4/20 | 0.40 |
| ▸ | PI4KA | P42356 | 1/20 | 0.40 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.40 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.40 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 3/20 | 0.39 |
| ▸ | ATG7 | O95352 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27651255 | 0.87 | CYP3A4 (0.45) | EGFRBTKCYP3A4CYP2C9NR3C1 | |
| SCHEMBL1501804 | 0.83 | CYP3A4 (0.62) | EGFRBTKCYP3A4CYP2C9NR3C1 | |
| SCHEMBL28057855 | 0.80 | MEN1 (0.44) | EGFRSRC | |
| SCHEMBL28794665 | 0.79 | ADA (0.43) | CYP3A4NR3C1PIK3CAMTORPIK3CG | |
| SCHEMBL13762806 | 0.78 | PI4KA (0.54) | EGFRBTKXDHAKT1AKT2 | |
| SCHEMBL30041613 | 0.78 | EGFR (0.55) | EGFRBTKXDHAKT1AKT2 | |
| SCHEMBL20744975 | 0.78 | EGFR (0.55) | EGFRBTKXDHAKT1AKT2 | |
| SCHEMBL27880685 | 0.76 | SRC (0.48) | EGFRSRCMTOR | |
| SCHEMBL2731599 | 0.76 | EGFR (0.67) | EGFRBTKCYP3A4CYP2C9NR3C1 | |
| SCHEMBL28791755 | 0.76 | EGFR (0.45) | EGFRBTKCYP3A4CYP2C9NR3C1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101242834-A | Inhibitors of AKT activity | MERCK & CO INC (US) | 2008-08-13 | — | — | CN | disclosed |
| CN-1809354-A | Inhibitors of Akt activity | MERCK & CO INC (US) | 2006-07-26 | — | — | CN | disclosed |