Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 13/20 | 0.63 |
| ▸ | JAK3 | P52333 | 2/20 | 0.35 |
| ▸ | BTK | Q06187 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TXK | P42681 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL16122845 | 0.88 | KRAS (0.77) | KRASERBB2 | |
| SCHEMBL16129123 | 0.86 | KRAS (0.62) | KRASJAK3BTKTXK | |
| SCHEMBL16117852 | 0.83 | KRAS (0.79) | KRASJAK3BTKTP53MAPT | |
| SCHEMBL16117858 | 0.82 | KRAS (0.85) | KRASERBB2 | |
| SCHEMBL31672380 | 0.82 | KRAS (0.85) | KRASERBB2 | |
| SCHEMBL16100289 | 0.82 | KRAS (0.83) | KRAS | |
| SCHEMBL16102399 | 0.82 | KRAS (0.83) | KRASERBB2 | |
| SCHEMBL16122797 | 0.82 | KRAS (0.67) | KRASJAK3BTKERBB2EGFR | |
| SCHEMBL31672331 | 0.82 | KRAS (0.83) | KRAS | |
| SCHEMBL17833942 | 0.81 | KRAS (0.67) | KRASJAK3TP53ERBB2EGFR |
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-2014152588-A1 | COVALENT INHIBITORS OF KRAS G12C | ARAXES PHARMA LLC (US) | 2014-09-25 | — | — | WO | disclosed |