Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 2/20 | 0.34 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.34 |
| ▸ | KCNK10 | P57789 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2994439 | 0.81 | CA1 (0.38) | PTPN1SMN1; SMN2TSHRCA1CA2 | |
| SCHEMBL5013864 | 0.80 | PTPN1 (0.38) | PTPN1SMN1; SMN2TSHRCA1CA2 | |
| SCHEMBL4306807 | 0.80 | MAPT (0.36) | TSHRCA1CA2CA5ACA9 | |
| SCHEMBL5017128 | 0.79 | PTPN1 (0.37) | PTPN1SMN1; SMN2TSHRCA1CA2 | |
| Trifluoromethanesulfonic Acid SCHEMBL29671356 | 0.79 | HSD11B1 (0.40) | PTPN1SMN1; SMN2TSHRCA1CA2 | |
| Lithium Ion SCHEMBL5015182 | 0.78 | GPR3 (0.39) | PTPN1SMN1; SMN2TSHRCA1CA2 | |
| Diphenylsulfane SCHEMBL6382661 | 0.77 | ALDH1A1 (0.44) | PTPN1SMN1; SMN2TSHRCA1CA2 | |
| Diphenylsulfane SCHEMBL31170665 | 0.75 | ALDH1A1 (0.42) | PTPN1SMN1; SMN2TSHRCA1CA2 | |
| Methylphenylsulfide SCHEMBL10707611 | 0.73 | ALDH1A1 (0.40) | PTPN1SMN1; SMN2TSHRCA1CA2 | |
| SCHEMBL13266199 | 0.73 | PTGS1 (0.44) | PTPN1SMN1; SMN2CA1CA2CA5A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008009815-A2 | METHOD FOR PREPARING AROMATIC SULFONATES | INSTITUT NATIONAL POLYTECHNIQUE DE GRENOBLE (FR) | 2008-01-24 | — | — | WO | disclosed |
| WO-2008009815-A2 | METHOD FOR PREPARING AROMATIC SULFONATES | INSTITUT NATIONAL POLYTECHNIQUE DE GRENOBLE (FR) | 2008-01-24 | — | — | WO | disclosed |