Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | PTPRB | P23467 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5838350 | 0.81 | ADORA1 (0.38) | ADORA1KDM4EALDH1A1MAPT | |
| SCHEMBL5837036 | 0.78 | PTPN1 (0.55) | PTPN2PTPN1PTPRB | |
| SCHEMBL7490616 | 0.77 | ALDH1A1 (0.34) | ADORA1KDM4EALDH1A1MAPTRAD52 | |
| SCHEMBL7861190 | 0.76 | CYP1A2 (0.42) | ADORA1KDM4EALDH1A1PTPN2PTPN1 | |
| SCHEMBL7536578 | 0.74 | PTPN1 (0.38) | PTPN2PTPN1PTPRB | |
| SCHEMBL7482552 | 0.72 | KDM4E (0.34) | ADORA1KDM4EALDH1A1MAPTRAD52 | |
| SCHEMBL5838672 | 0.70 | ADORA1 (0.38) | ADORA1KDM4EALDH1A1MAPTDRD1 | |
| SCHEMBL7486653 | 0.70 | ADORA1 (0.43) | ADORA1ALDH1A1MAPT | |
| SCHEMBL27558405 | 0.67 | ALDH1A1 (0.43) | ADORA1KDM4EALDH1A1MAPTRAD52 | |
| SCHEMBL6317021 | 0.67 | ADORA1 (0.35) | ADORA1KDM4EALDH1A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1214060-A2 | METHOD OF INHIBITING PROTEIN TYROSINE PHOSPHATASE 1B AND/OR T-CELL PROTEIN TYROSINE PHOSPHATASE AND/OR OTHER PTPASES WITH AN ASP RESIDUE AT POSITION 48 | NOVO NORDISK A/S (DK) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001017516-A2 | METHOD OF INHIBITING PROTEIN TYROSINE PHOSPHATASE 1B AND/OR T-CELL PROTEIN TYROSINE PHOSPHATASE AND/OR OTHER PTPASES WITH AN ASP RESIDUE AT POSITION 48 | NOVO NORDISK A/S (DK) | 2001-03-15 | — | — | WO | disclosed |