Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHAT | P28329 | 6/20 | 0.55 |
| ▸ | RXRA | P19793 | 1/20 | 0.53 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.53 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29693644 | 1.00 | CHAT (0.55) | CHATRXRAMTNR1AMTNR1BPTGS1 | |
| SCHEMBL1681129 | 1.00 | CHAT (0.55) | CHATRXRAMTNR1AMTNR1BPTGS1 | |
| SCHEMBL272577 | 1.00 | CHAT (0.55) | CHATRXRAMTNR1AMTNR1BPTGS1 | |
| SCHEMBL612947 | 1.00 | CHAT (0.55) | CHATRXRAMTNR1AMTNR1BPTGS1 | |
| SCHEMBL5478934 | 0.88 | HPRT1 (0.54) | CHATRXRAMTNR1AMTNR1BPTGS1 | |
| SCHEMBL10706694 | 0.85 | CHAT (0.62) | CHATRXRAMTNR1AMTNR1BPTGS1 | |
| SCHEMBL10706687 | 0.85 | CHAT (0.62) | CHATRXRAMTNR1AMTNR1BPTGS1 | |
| SCHEMBL10706700 | 0.85 | CHAT (0.62) | CHATRXRAMTNR1AMTNR1BPTGS1 | |
| SCHEMBL10437275 | 0.83 | CHAT (0.60) | CHATRXRAMTNR1AMTNR1BPTGS1 | |
| SCHEMBL10437274 | 0.83 | CHAT (0.60) | CHATRXRAMTNR1AMTNR1BPTGS1 |
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-4247807-A1 | 6,7-DIHYDRO-PYRANO[2,3-D]PYRIMIDINE INHIBITORS OF KRAS G12C MUTANT | Merck Sharp & Dohme LLC (US) | 2023-09-27 | — | — | EP | disclosed |
| WO-2022109485-A1 | 6,7-DIHYDRO-PYRANO[2,3-D]PYRIMIDINE INHIBITORS OF KRAS G12C MUTANT | MERCK SHARP & DOHME CORP. (US) | 2022-05-27 | — | — | WO | disclosed |