Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20326205 | 0.90 | MEN1 (0.30) | MEN1KMT2AFAAHMAPK1 | |
| SCHEMBL20334416 | 0.84 | TSHR (0.33) | MEN1KMT2AFAAHMAPK1TSHR | |
| SCHEMBL20314934 | 0.83 | CTSK (0.34) | MEN1KMT2AFAAHMAPK1TSHR | |
| SCHEMBL20334812 | 0.82 | CHRNB2 (0.31) | — | |
| SCHEMBL29952827 | 0.76 | TSHR (0.38) | MEN1KMT2AFAAHMAPK1TSHR | |
| SCHEMBL21741220 | 0.76 | POLB (0.37) | MEN1KMT2ATSHR | |
| SCHEMBL23475900 | 0.75 | MEN1 (0.43) | MEN1KMT2AFAAHMAPK1TSHR | |
| SCHEMBL21794811 | 0.75 | ALDH1A1 (0.32) | TSHRALDH1A1 | |
| SCHEMBL23735865 | 0.75 | — | — | |
| SCHEMBL22035847 | 0.74 | MEN1 (0.44) | MEN1KMT2AFAAHMAPK1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3558955-B1 | BENZISOTHIAZOLE, ISOTHIAZOLO[3,4-B]PYRIDINE, QUINAZOLINE, PHTHALAZINE, PYRIDO[2,3-D]PYRIDAZINE AND PYRIDO[2,3-D]PYRIMIDINE DERIVATIVES AS KRAS G12C INHIBITORS FOR TREATING LUNG, PANCREATIC OR COLORECTAL CANCER | AMGEN INC (US) | 2021-08-11 | — | — | EP | disclosed |