Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | PSMB1 | P20618 | 2/20 | 0.55 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.55 |
| ▸ | PSMB2 | P49721 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 4/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.54 |
| ▸ | LTA4H | P09960 | 2/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL30983883 | 0.88 | KDM4E (0.65) | KDM4EPOLBALDH1A1SMN1; SMN2HRH3 | |
| SCHEMBL5755028 | 0.87 | KDM4E (0.71) | KDM4EALDH1A1LTA4H | |
| SCHEMBL30983972 | 0.87 | KDM4E (0.55) | KDM4EPOLBALDH1A1SMN1; SMN2HRH3 | |
| SCHEMBL30984033 | 0.85 | KDM4E (0.55) | KDM4EPOLBALDH1A1SMN1; SMN2HRH3 | |
| SCHEMBL4661967 | 0.84 | MAOB (0.58) | KDM4EPOLBPSMB1PSMB5PSMB2 | |
| SCHEMBL1283667 | 0.83 | PSMB1 (0.54) | KDM4EPOLBPSMB1PSMB5PSMB2 | |
| SCHEMBL30983936 | 0.82 | MEN1 (0.50) | KDM4EPOLBALDH1A1SMN1; SMN2ESR1 | |
| SCHEMBL1628165 | 0.82 | ALDH1A1 (0.57) | KDM4EALDH1A1SMN1; SMN2HRH3 | |
| SCHEMBL15474972 | 0.82 | LTA4H (0.54) | POLBPSMB1PSMB5PSMB2ALDH1A1 | |
| SCHEMBL30984087 | 0.81 | KDM4E (0.44) | KDM4EPOLBALDH1A1SMN1; SMN2HRH3 |
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-1997030985-A1 | BENZOTHIOPHENES, AND FORMULATIONS AND METHODS, USING SAME | ELI LILLY AND COMPANY (US) | 1997-08-28 | — | — | WO | disclosed |