Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STS | P08842 | 1/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6818498 | 0.84 | ALDH1A1 (0.55) | PTPN1PTPN6PTPN11ALDH1A1CA1 | |
| SCHEMBL6821752 | 0.81 | CA1 (0.45) | STSPTPN1PTPN6PTPN11CYP3A4 | |
| SCHEMBL6821033 | 0.78 | PTPN1 (0.46) | PTPN1PTPN6PTPN11CYP3A4CYP2C19 | |
| SCHEMBL6821024 | 0.77 | PPID (0.44) | CYP3A4CYP2C19L3MBTL1ALDH1A1CA1 | |
| SCHEMBL6818574 | 0.77 | SMN1; SMN2 (0.52) | PTPN1PTPN6PTPN11ALDH1A1CA1 | |
| SCHEMBL12127405 | 0.70 | CNR1 (0.67) | CYP3A4CYP2C19L3MBTL1ALDH1A1 | |
| SCHEMBL17282175 | 0.70 | CYP3A4 (0.62) | CYP3A4CYP2C19L3MBTL1ALDH1A1HDAC3 | |
| SCHEMBL6821832 | 0.70 | CYP3A4 (0.51) | CYP3A4CYP2C19L3MBTL1ALDH1A1CA1 | |
| SCHEMBL6824244 | 0.70 | CYP3A4 (0.66) | CYP3A4CYP2C19L3MBTL1ALDH1A1HDAC3 | |
| SCHEMBL18134836 | 0.70 | CYP3A4 (0.65) | CYP3A4CYP2C19L3MBTL1ALDH1A1HDAC3 |
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 |