Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 9/20 | 0.33 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.30 |
| ▸ | SRC | P12931 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11057092 | 0.90 | CHRNA7 (0.44) | HCAR1CHRNA7EGFRFGFR1SRC | |
| SCHEMBL11054223 | 0.88 | KMT2A (0.36) | HCAR1CHRNA7 | |
| SCHEMBL11058209 | 0.85 | HCAR1 (0.38) | HCAR1CHRNA7SRC | |
| SCHEMBL11059281 | 0.84 | KDM4E (0.37) | — | |
| SCHEMBL11053099 | 0.84 | HCAR1 (0.37) | HCAR1CHRNA7FGFR1 | |
| SCHEMBL11054647 | 0.84 | HCAR1 (0.37) | HCAR1CHRNA7EGFRFGFR1 | |
| SCHEMBL11061839 | 0.84 | HCAR1 (0.37) | HCAR1CHRNA7 | |
| SCHEMBL11061669 | 0.82 | WEE1 (0.44) | CHRNA7FGFR1SRC | |
| SCHEMBL11053291 | 0.81 | HCAR1 (0.35) | HCAR1CHRNA7EGFRFGFR1 | |
| SCHEMBL11054404 | 0.81 | HCAR1 (0.46) | HCAR1CHRNA7EGFRFGFR1SRC |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4452980-A | DIARRHEA | WILLIAM H. RORER, INC. (US) | 1984-06-05 | — | — | US | disclosed |
| US-4246409-A | ANTIDIARRHEAL AGENTS | WILLIAM H. RORER, INC. (US) | 1981-01-20 | — | — | US | disclosed |
| US-4225315-A | Triazinones from amidinoureas | WILLIAM H. RORER, INC. (US) | 1980-09-30 | — | — | US | disclosed |