Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.33 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL170934 | 0.84 | GABRA1 (0.46) | MPOACHETAAR1CYP1A2CYP2A6 | |
| SCHEMBL1145714 | 0.82 | MPO (0.38) | MPOACHETAAR1CYP1A2CYP2A6 | |
| SCHEMBL6405866 | 0.79 | TAAR1 (0.46) | MPOACHETAAR1CYP1A2CYP2A6 | |
| SCHEMBL13180051 | 0.79 | MPO (0.39) | MPOACHETAAR1CYP1A2CYP2A6 | |
| SCHEMBL4428644 | 0.77 | MPO (0.38) | MPOACHETAAR1CYP1A2CYP2A6 | |
| SCHEMBL1145821 | 0.77 | IDO1 (0.38) | MPOACHETAAR1CYP1A2CYP2A6 | |
| SCHEMBL8343195 | 0.77 | MPO (0.38) | MPOACHETAAR1CYP1A2CYP2A6 | |
| SCHEMBL177422 | 0.77 | MPO (0.38) | MPOACHETAAR1CYP1A2CYP2A6 | |
| SCHEMBL1145716 | 0.77 | PDCD1 (0.44) | MPOACHETAAR1CYP1A2CYP2A6 | |
| SCHEMBL1145818 | 0.77 | MPO (0.38) | MPOACHETAAR1CYP1A2CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1255738-B1 | GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO | NEUROCRINE BIOSCIENCES INC (US) | 2012-03-07 | — | — | EP | disclosed |