Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 5/20 | 0.51 |
| ▸ | TLR9 | Q9NR96 | 4/20 | 0.45 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.45 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.38 |
| ▸ | YAP1 | P46937 | 3/20 | 0.38 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19948037 | 1.00 | KRAS (0.51) | KRASTLR9TLR7GPR119YAP1 | |
| SCHEMBL19947881 | 0.91 | KRAS (0.62) | KRASTLR9TLR7ACHE | |
| SCHEMBL19616896 | 0.91 | KRAS (0.62) | KRASTLR9TLR7ACHE | |
| SCHEMBL19948546 | 0.87 | KRAS (0.49) | KRASTLR9TLR7GPR119YAP1 | |
| SCHEMBL19617095 | 0.87 | KRAS (0.49) | KRASTLR9TLR7GPR119YAP1 | |
| SCHEMBL19948464 | 0.81 | KRAS (0.45) | KRASTLR9TLR7GPR119ACHE | |
| SCHEMBL19616964 | 0.81 | KRAS (0.45) | KRASTLR9TLR7GPR119ACHE | |
| SCHEMBL30189120 | 0.81 | KRAS (0.54) | KRASTLR9TLR7GPR119YAP1 | |
| SCHEMBL19617874 | 0.81 | KRAS (0.54) | KRASTLR9TLR7GPR119YAP1 | |
| SCHEMBL19637127 | 0.81 | KRAS (0.77) | KRAS |
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 |
|---|---|---|---|---|---|---|---|
| EP-3458445-A1 | KRAS G12C INHIBITORS | Mirati Therapeutics, Inc. (US) | 2019-03-27 | — | — | EP | disclosed |
| WO-2017201161-A1 | KRAS G12C INHIBITORS | Mirati Therapeutics, Inc. (US) | 2017-11-23 | — | — | WO | disclosed |