Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.72 |
| ▸ | TPMT | P51580 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.40 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.34 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | PHGDH | O43175 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6789159 | 0.84 | GSK3B (1.00) | GSK3BTPMTCA1CA2SLC6A2 | |
| SCHEMBL5757857 | 0.80 | GSK3B (0.69) | GSK3BTPMTCA1CA2SLC6A2 | |
| SCHEMBL3992793 | 0.79 | TDP1 (0.52) | GSK3BCA1CA2PTPN1ALDH1A1 | |
| SCHEMBL24408904 | 0.74 | GSK3B (0.61) | GSK3BTPMTCA1CA2SLC6A2 | |
| SCHEMBL1964826 | 0.74 | GSK3B (0.61) | GSK3BTPMTCA1CA2SLC6A2 | |
| SCHEMBL13178294 | 0.74 | GSK3B (0.60) | GSK3BTPMTCA1CA2PDPK1 | |
| SCHEMBL4936099 | 0.72 | GSK3B (0.58) | GSK3BTPMTCA1CA2SLC6A2 | |
| SCHEMBL5873202 | 0.71 | GSK3B (0.56) | GSK3BTPMTCA1CA2PDPK1 | |
| SCHEMBL5318489 | 0.71 | GSK3B (0.56) | GSK3BTPMTCA1CA2PDPK1 | |
| SCHEMBL22309048 | 0.71 | CES2 (0.58) | GSK3BTPMTCA1CA2SLC6A2 |
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-1942899-A2 | MITOTIC KINESIN INHIBITORS | Cytokinetics, Inc. (US) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007056056-A2 | MITOTIC KINESIN INHIBITORS | CYTOKINETICS, INC. (US) | 2007-05-18 | — | — | WO | disclosed |