Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 7/20 | 0.42 |
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | F13A1 | P00488 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6821984 | 0.84 | PTPN1 (0.40) | CA2CA1KDM4EPTPN1PTPN6 | |
| SCHEMBL6818212 | 0.81 | PPID (0.41) | CA2CA1CA12CA14CA7 | |
| SCHEMBL6821752 | 0.81 | CA1 (0.45) | CA2CA1PTPN1PTPN6PTPN11 | |
| SCHEMBL6818574 | 0.79 | SMN1; SMN2 (0.52) | SMN1; SMN2CA2CA1KDM4EF13A1 | |
| SCHEMBL6818169 | 0.78 | ALDH1A1 (0.39) | CA1CA12CA14CA7ALDH1A1 | |
| SCHEMBL19085535 | 0.71 | NAMPT (0.57) | SMN1; SMN2CA2CA1KDM4EF13A1 | |
| SCHEMBL6824712 | 0.71 | ALDH1A1 (0.47) | CA2CA1CA12CA14CA7 | |
| SCHEMBL5120240 | 0.70 | CA12 (0.40) | SMN1; SMN2CA2CA1PTPN1PTPN6 | |
| SCHEMBL28848653 | 0.70 | CA2 (0.56) | SMN1; SMN2CA2CA1 | |
| SCHEMBL8786369 | 0.70 | CYP4F2 (0.55) | SMN1; SMN2CA2CA1ALDH1A1 |
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 |