Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.32 |
| ▸ | KCNK10 | P57789 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5013864 | 0.98 | PTPN1 (0.38) | PTPN1TSHRSMN1; SMN2CA1CA2 | |
| SCHEMBL17268306 | 0.82 | PTPN1 (0.33) | PTPN1 | |
| SCHEMBL2992202 | 0.81 | CA1 (0.35) | PTPN1TSHRSMN1; SMN2CA1CA2 | |
| SCHEMBL5015191 | 0.80 | CA2 (0.38) | SMN1; SMN2CA1CA2CA5ACA9 | |
| SCHEMBL2989976 | 0.80 | PTGS1 (0.38) | PTPN1CA1CA2CA5ACA9 | |
| SCHEMBL5017164 | 0.79 | PTPN1 (0.40) | PTPN1TSHRSMN1; SMN2CA1CA2 | |
| Lithium Ion SCHEMBL5017125 | 0.78 | GPR3 (0.37) | PTPN1SMN1; SMN2CA1CA2HSD11B1 | |
| SCHEMBL19611303 | 0.78 | PTGS1 (0.39) | PTPN1CA1CA2CA5ACA9 | |
| SCHEMBL5013907 | 0.76 | TDP1 (0.44) | LMNAALDH1A1THRBKMT2A | |
| SCHEMBL2991879 | 0.76 | PTGS1 (0.42) | PTPN1SMN1; SMN2CA1CA2PTGS1 |
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-2008009815-A2 | METHOD FOR PREPARING AROMATIC SULFONATES | INSTITUT NATIONAL POLYTECHNIQUE DE GRENOBLE (FR) | 2008-01-24 | — | — | WO | disclosed |