Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6818289 | 0.84 | STS (0.47) | ALDH1A1LMNACA12CA1CA2 | |
| SCHEMBL6821033 | 0.77 | PTPN1 (0.46) | ALDH1A1PTPN1PTPN6PTPN11KMT2A | |
| SCHEMBL17117495 | 0.77 | CA1 (0.76) | ALDH1A1TRPV1LMNACA12CA1 | |
| SCHEMBL9080237 | 0.76 | MEN1 (0.83) | ALDH1A1TRPV1LMNAMEN1KMT2A | |
| SCHEMBL6818574 | 0.76 | SMN1; SMN2 (0.52) | ALDH1A1LMNACA1CA2PTPN1 | |
| SCHEMBL28732580 | 0.75 | ALDH1A1 (0.92) | ALDH1A1TRPV1LMNAMEN1KMT2A | |
| SCHEMBL6824712 | 0.75 | ALDH1A1 (0.47) | ALDH1A1TRPV1LMNACA12CA1 | |
| SCHEMBL6822042 | 0.75 | ALDH1A1 (0.62) | ALDH1A1TRPV1LMNAMEN1KMT2A | |
| SCHEMBL7763386 | 0.74 | MEN1 (0.86) | ALDH1A1TRPV1LMNAMEN1KMT2A | |
| SCHEMBL17117290 | 0.74 | ALDH1A1 (0.62) | ALDH1A1TRPV1LMNACA12CA1 |
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 |