Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4968054 | 0.94 | PARP1 (0.43) | MEN1KMT2ACYP2D6CYP2C19CYP3A4 | |
| SCHEMBL4966170 | 0.86 | KDM4E (0.48) | MEN1KMT2ACYP2D6CYP2C19CYP3A4 | |
| SCHEMBL4965202 | 0.84 | KDM4E (0.45) | MEN1KMT2ACYP2D6CYP2C19CYP3A4 | |
| SCHEMBL4965638 | 0.82 | OPRM1 (0.41) | CYP2D6CYP2C19 | |
| SCHEMBL4965138 | 0.82 | MCHR1 (0.43) | MEN1KMT2AALDH1A1POLB | |
| SCHEMBL4963457 | 0.82 | SLC2A1 (0.42) | CYP2D6CYP2C19 | |
| SCHEMBL4968023 | 0.81 | OPRM1 (0.46) | MAPTPOLBKCNH2 | |
| SCHEMBL4965633 | 0.81 | OPRM1 (0.45) | MEN1KMT2ACYP2D6CYP2C19CYP3A4 | |
| SCHEMBL4966629 | 0.81 | SLC2A1 (0.37) | MEN1KMT2ACYP2D6CYP2C19CYP3A4 | |
| SCHEMBL4967478 | 0.80 | KDM4E (0.49) | MEN1KMT2AALDH1A1MAPTHTT |
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-1730140-B1 | OPIOID RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-06-25 | — | — | EP | claimed |