Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CETP | P11597 | 4/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11106147 | 0.89 | TAAR1 (0.44) | TAAR1SLC6A2FDPSCYP1A2CYP2C9 | |
| SCHEMBL7989802 | 0.84 | CYP1A2 (0.41) | TAAR1SLC6A2FDPSCYP1A2CYP2C9 | |
| SCHEMBL7989799 | 0.84 | CYP1A2 (0.41) | TAAR1SLC6A2FDPSCYP1A2CYP2C9 | |
| SCHEMBL14779954 | 0.84 | GAA (0.44) | TAAR1SLC6A2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28135896 | 0.82 | TAAR1 (0.47) | TAAR1SLC6A2FDPSCYP1A2CYP2C9 | |
| SCHEMBL925449 | 0.81 | CYP1A2 (0.52) | TAAR1SLC6A2FDPSCYP1A2CYP2C9 | |
| SCHEMBL27671625 | 0.77 | CYP2C19 (0.48) | TAAR1SLC6A2FDPSCYP1A2CYP2C9 | |
| SCHEMBL9545396 | 0.77 | CYP2C19 (0.48) | TAAR1SLC6A2FDPSCYP1A2CYP2C9 | |
| SCHEMBL31427515 | 0.77 | SLC6A2 (0.45) | TAAR1SLC6A2FDPSCYP1A2CYP2C9 | |
| Acetic Acid SCHEMBL27845326 | 0.77 | SMN1; SMN2 (0.50) | TAAR1SLC6A2FDPSCYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-4456616-A | 7-Oxabicycloheptane substituted amino prostaglandin analogs and their use in inhibiting platelet aggregation and bronchoconstriction | E. R. SQUIBB & SONS, INC. (US) | 1984-06-26 | — | — | US | disclosed |