Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 5/20 | 0.40 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 5/20 | 0.38 |
| ▸ | CA2 | P00918 | 4/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MLYCD | O95822 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL6820995 | 0.84 | SMN1; SMN2 (0.44) | PTPN1PTPN6PTPN11CA1CA2 | |
| SCHEMBL6821752 | 0.82 | CA1 (0.45) | PTPN1PTPN6PTPN11CA1CA2 | |
| SCHEMBL6821033 | 0.80 | PTPN1 (0.46) | PTPN1PTPN6PTPN11ALDH1A1NR1I2 | |
| SCHEMBL6818212 | 0.72 | PPID (0.41) | CA1CA2CA12CA14ALDH1A1 | |
| SCHEMBL6824712 | 0.72 | ALDH1A1 (0.47) | CA1CA2CA12CA14ALDH1A1 | |
| SCHEMBL5120240 | 0.69 | CA12 (0.40) | PTPN1PTPN6PTPN11CA1CA2 | |
| SCHEMBL5892950 | 0.69 | ITGB3 (0.46) | PTPN1CYP2C9CYP2C19HTT | |
| SCHEMBL1731086 | 0.69 | GAA (0.46) | CA1CA2CA12CA14ALDH1A1 | |
| SCHEMBL15354550 | 0.67 | CA12 (0.39) | CA1CA2CA12CA14ALDH1A1 | |
| SCHEMBL14805406 | 0.67 | NR1H2 (0.41) | PTPN1PTPN6PTPN11NR1H2CA1 |
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-2004050646-A1 | 1, 2, 5-THIADIAZOLIDIN-3-ONE 1, 1 DIOXIDE DERIVATIVES AS INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE PTP1B | ASTRAZENECA AB (SE) | 2004-06-17 | — | — | WO | disclosed |