Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 2/20 | 0.70 |
| ▸ | PTGS2 | P35354 | 9/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | CA3 | P07451 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Methylphenylsulfone SCHEMBL78253 | 0.87 | PTGS2 (0.62) | ENPP2PTGS2CA12CA1CA2 | |
| Methylphenylsulfone SCHEMBL1332357 | 0.87 | PTGS2 (0.62) | ENPP2PTGS2CA12CA1CA2 | |
| Methylphenylsulfone SCHEMBL5499087 | 0.85 | PTGS2 (0.60) | ENPP2PTGS2CA12CA1CA2 | |
| Methylphenylsulfone SCHEMBL561404 | 0.83 | PTGS2 (0.54) | ENPP2PTGS2TSHRSMN1; SMN2HTR6 | |
| Methylphenylsulfone SCHEMBL28288198 | 0.82 | PTGS2 (0.58) | ENPP2PTGS2CA12CA1CA2 | |
| Methylphenylsulfone SCHEMBL28158010 | 0.82 | PTGS2 (0.58) | ENPP2PTGS2CA12CA1CA2 | |
| Methylphenylsulfone SCHEMBL28046614 | 0.82 | PTGS2 (0.58) | ENPP2PTGS2CA12CA1CA2 | |
| SCHEMBL1535 | 0.82 | ENPP2 (1.00) | ENPP2PTGS2CA12CA1CA2 | |
| Methylphenylsulfone SCHEMBL28097901 | 0.82 | PTGS2 (0.58) | ENPP2PTGS2CA12CA1CA2 | |
| Phenol SCHEMBL94009 | 0.82 | CA1 (0.61) | ENPP2CA12CA1CA2GLA |
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 |
|---|---|---|---|---|---|---|---|
| CN-109563103-A | modulators of beta-3 adrenergic receptors for the treatment or prevention of disorders related thereto | 艾尼纳制药公司 | 2019-04-02 | — | — | CN | disclosed |