Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL197638 | 0.87 | — | — | |
| Water SCHEMBL28044737 | 0.84 | — | — | |
| SCHEMBL30129770 | 0.84 | — | — | |
| SCHEMBL28044800 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL6069542 | 0.84 | — | — | |
| Water SCHEMBL28044696 | 0.81 | HCAR2 (0.48) | HCAR2TSHRCHRNB2CHRNA4CYP11B1 | |
| SCHEMBL27399560 | 0.80 | HCAR2 (0.43) | HCAR2TSHRCHRNB2CHRNA4CYP11B1 | |
| Cyanide SCHEMBL28048122 | 0.79 | HCAR2 (0.46) | HCAR2TSHRCHRNB2CHRNA4CYP11B1 | |
| Formaldehyde SCHEMBL28060910 | 0.79 | HCAR2 (0.52) | HCAR2TSHRCHRNB2CHRNA4CHRNB4 | |
| SCHEMBL28151623 | 0.77 | HCAR2 (0.50) | HCAR2TSHRCHRNB2CHRNA4CHRNB4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0471755-B1 | N-FLUOROPYRIDINIUM PYRIDINE HEPTAFLUORODIBORATE | ALLIED SIGNAL INC (US) | 1993-11-18 | — | — | EP | disclosed |
| US-5243080-A | Ether and ester compounds | ALLIEDSIGNAL INC. (US) | 1993-09-07 | — | — | US | disclosed |
| US-5162587-A | METHOD FOR FLUORINATING BY USING N-FLUOROPYRIDINIUM PYRIDINE HEPTAFLUORODIBORATE | ALLIED-SIGNAL INC. | 1992-11-10 | — | — | US | disclosed |
| WO-1992012983-A1 | A METHOD OF FLUORINATING BY USING N-FLUOROPYRIDINIUM PYRIDINE HEPTAFLUORODIBORATE | ALLIED-SIGNAL INC. (US) | 1992-08-06 | — | — | WO | disclosed |
| US-5086190-A | Heating and reacting androstadienes with the complexes in solvent | ALLIED-SIGNAL INC. (US) | 1992-02-04 | — | — | US | disclosed |
| US-4935519-A | Fluorination agent | ALLIED-SIGNAL INC. (US) | 1990-06-19 | — | — | US | disclosed |