Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR1 | Q9BXC0 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.31 |
| ▸ | GBA1 | P04062 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | CRHR1 | P34998 | 3/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 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 | |
|---|---|---|---|---|
| SCHEMBL11055971 | 0.89 | HCAR1 (0.36) | HCAR1CHRNA7 | |
| SCHEMBL11055471 | 0.87 | HCAR1 (0.38) | HCAR1ALOX15SMN1; SMN2GRIN1GRIN2A | |
| SCHEMBL11053236 | 0.87 | HCAR1 (0.38) | HCAR1CHRNA7 | |
| SCHEMBL11055569 | 0.85 | CHRNA7 (0.43) | HCAR1CHRNA7 | |
| SCHEMBL11056383 | 0.83 | HCAR1 (0.40) | HCAR1ALOX15CRHR1 | |
| SCHEMBL11060209 | 0.82 | HCAR1 (0.41) | HCAR1ALOX15CRHR1 | |
| SCHEMBL11058424 | 0.81 | HCAR1 (0.37) | HCAR1ALOX15SMN1; SMN2GRIN1GRIN2A | |
| SCHEMBL11057683 | 0.80 | MAPK14 (0.34) | HCAR1SMN1; SMN2CHRNA7 | |
| SCHEMBL11056476 | 0.79 | HCAR1 (0.40) | HCAR1CHRNA7 | |
| SCHEMBL11059656 | 0.79 | HCAR1 (0.43) | HCAR1SMN1; SMN2CHRNA7 |
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 |