Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.33 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 2/20 | 0.32 |
| ▸ | CES1 | P23141 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL367263 | 0.92 | LTA4H (0.38) | LTA4HPCSK9PTGS2ESR1CES2 | |
| SCHEMBL27678592 | 0.90 | LTA4H (0.36) | LTA4HPCSK9PTGS2ESR1CES2 | |
| Hydrochloric Acid SCHEMBL11572407 | 0.90 | LTA4H (0.36) | LTA4HPCSK9PTGS2ESR1CES2 | |
| Hydrochloric Acid SCHEMBL11572419 | 0.90 | LTA4H (0.36) | LTA4HPCSK9PTGS2ESR1CES2 | |
| Hydrochloric Acid SCHEMBL9619305 | 0.90 | LTA4H (0.36) | LTA4HPCSK9PTGS2ESR1CES2 | |
| Bromide SCHEMBL25216737 | 0.90 | LTA4H (0.36) | LTA4HPCSK9PTGS2ESR1CES2 | |
| Butane SCHEMBL27520586 | 0.90 | LTA4H (0.36) | LTA4HPCSK9PTGS2ESR1CES2 | |
| SCHEMBL4058104 | 0.87 | — | — | |
| SCHEMBL3445934 | 0.85 | LTA4H (0.38) | LTA4HPCSK9PTGS2CES2CES1 | |
| SCHEMBL5394695 | 0.83 | DNM1 (0.40) | LTA4HPTGS2ESR1CES2CES1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010057121-A1 | PYRAZINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS | AMGEN INC. (US) | 2010-05-20 | — | — | WO | disclosed |