Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 5/20 | 0.46 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.46 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MLYCD | O95822 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL6818574 | 0.81 | SMN1; SMN2 (0.52) | PTPN1PTPN6PTPN11ALDH1A1KDM4E | |
| SCHEMBL6821984 | 0.80 | PTPN1 (0.40) | PTPN1PTPN6PTPN11ALDH1A1NR1I2 | |
| SCHEMBL6818289 | 0.78 | STS (0.47) | PTPN1PTPN6PTPN11ALDH1A1CYP3A4 | |
| SCHEMBL6818498 | 0.77 | ALDH1A1 (0.55) | PTPN1PTPN6PTPN11ALDH1A1KMT2A | |
| SCHEMBL8911467 | 0.76 | CA12 (0.43) | PTPN1PTPN6PTPN11ALDH1A1KDM4E | |
| SCHEMBL14387746 | 0.72 | HDAC1 (0.53) | ALDH1A1KDM4EPOLBHTT | |
| SCHEMBL6821807 | 0.69 | CA1 (0.50) | ALDH1A1KDM4EKMT2AHSD17B10 | |
| SCHEMBL6821960 | 0.69 | FFAR1 (0.52) | ALDH1A1RAB9AKDM4EKMT2APOLB | |
| SCHEMBL12228278 | 0.69 | F2RL1 (0.69) | ALDH1A1KMT2APOLBHTT | |
| SCHEMBL6865397 | 0.68 | TPSAB1 (0.52) | ALDH1A1POLB |
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 |