Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3679517 | 0.82 | CYP2C9 (0.35) | SMN1; SMN2CYP3A4CYP2C19MEN1KMT2A | |
| SCHEMBL8763832 | 0.74 | OPRM1 (0.50) | SMN1; SMN2GAAOPRM1OPRD1OPRK1 | |
| SCHEMBL16915056 | 0.72 | MEN1 (0.40) | SMN1; SMN2CYP3A4CYP2C19MEN1KMT2A | |
| SCHEMBL576440 | 0.69 | MMP2 (0.40) | SMN1; SMN2MEN1KMT2ATSHR | |
| SCHEMBL14350785 | 0.69 | MMP2 (0.40) | SMN1; SMN2MEN1KMT2ATSHR | |
| SCHEMBL3678845 | 0.69 | KCNA3 (0.36) | SMN1; SMN2CYP3A4CYP2C19MEN1KMT2A | |
| SCHEMBL577105 | 0.69 | MEN1 (0.41) | SMN1; SMN2OPRM1OPRK1OPRL1MEN1 | |
| SCHEMBL28589492 | 0.68 | TP53 (0.38) | SMN1; SMN2OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL4319672 | 0.67 | OPRM1 (0.37) | SMN1; SMN2OPRM1OPRD1OPRK1SLC22A1 | |
| SCHEMBL29269212 | 0.66 | — | — |
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-4118090-A1 | METHODS OF MODULATING GASTROINTESTINAL MICROBIAL METABOLIC PATHWAYS AND METABOLITES | DSM IP Assets B.V. (NL) | 2023-01-18 | — | — | EP | disclosed |