Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 20/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL22967614 | 0.97 | KRAS (0.70) | KRAS | |
| Trifluoroacetic Acid SCHEMBL28533601 | 0.96 | KRAS (0.65) | KRAS | |
| Trifluoroacetic Acid SCHEMBL28538146 | 0.94 | KRAS (0.65) | KRAS | |
| SCHEMBL28526863 | 0.92 | KRAS (0.59) | KRAS | |
| SCHEMBL28538127 | 0.92 | KRAS (0.72) | KRAS | |
| SCHEMBL22967615 | 0.91 | KRAS (0.63) | KRAS | |
| SCHEMBL22967618 | 0.91 | KRAS (0.62) | KRAS | |
| SCHEMBL28528029 | 0.90 | KRAS (0.56) | KRAS | |
| SCHEMBL22967727 | 0.89 | KRAS (0.73) | KRAS | |
| SCHEMBL22720096 | 0.89 | KRAS (0.70) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112442029-A | Tetrahydropyrido [3,4-d ] pyrimidine derivative and application thereof in medicine | 四川海思科制药有限公司 | 2021-03-05 | — | — | CN | disclosed |