Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOAT1 | P35610 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | DGKA | P23743 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 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 | |
|---|---|---|---|---|
| SCHEMBL6931251 | 0.98 | SOAT1 (0.48) | SOAT1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL1826675 | 0.93 | CYP3A4 (0.42) | SOAT1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL28514362 | 0.91 | MEN1 (0.55) | SOAT1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL28516282 | 0.89 | MEN1 (0.59) | SOAT1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL28194349 | 0.89 | SOAT1 (0.59) | SOAT1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL21342076 | 0.89 | CYP3A4 (0.39) | SOAT1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL14389204 | 0.89 | MEN1 (0.59) | SOAT1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL27956888 | 0.89 | MEN1 (0.59) | SOAT1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL4148199 | 0.86 | — | — | |
| SCHEMBL22266465 | 0.84 | CES2 (0.55) | CYP1A2CYP3A4CYP2C19MEN1KMT2A |
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-2005092841-A1 | COMPOUNDS HAVING BETA-AGONIST ACTIVITY | PFIZER LIMITED (GB) | 2005-10-06 | — | — | WO | disclosed |