Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1731086 | 0.83 | GAA (0.46) | ALDH1A1CA12CA1CA7CA14 | |
| SCHEMBL6821770 | 0.81 | ALDH1A1 (0.45) | ALDH1A1TRPV1MTNR1AMTNR1BPOLB | |
| SCHEMBL6820995 | 0.78 | SMN1; SMN2 (0.44) | ALDH1A1CA12CA1CA7CA14 | |
| SCHEMBL6818212 | 0.76 | PPID (0.41) | ALDH1A1CA12CA1CA7CA14 | |
| SCHEMBL6821752 | 0.73 | CA1 (0.45) | CA12CA1CA7CA14 | |
| SCHEMBL648387 | 0.71 | KEAP1 (0.48) | ALDH1A1CA12CA1CA7CA14 | |
| SCHEMBL28578328 | 0.69 | ALDH1A1 (0.40) | ALDH1A1MTNR1AMTNR1BCA12CA1 | |
| SCHEMBL1731157 | 0.69 | CA12 (0.41) | ALDH1A1MTNR1AMTNR1BCA12CA1 | |
| SCHEMBL6821984 | 0.69 | PTPN1 (0.40) | ALDH1A1CA12CA1CA7CA14 | |
| SCHEMBL4957519 | 0.69 | ALDH1A1 (0.47) | ALDH1A1MTNR1AMTNR1BCA12CA1 |
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 |