Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.34 |
| ▸ | MYC | P01106 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 5/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | TPMT | P51580 | 1/20 | 0.32 |
| ▸ | TTR | P02766 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | PLK1 | P53350 | 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 | |
|---|---|---|---|---|
| SCHEMBL7017012 | 0.69 | HSD11B1 (0.41) | — | |
| SCHEMBL9393020 | 0.67 | NPC1 (0.43) | KDM4EALDH1A1 | |
| SCHEMBL27990860 | 0.67 | ALDH1A1 (0.49) | KDM4ENOTUMTTRALDH1A1 | |
| SCHEMBL28146663 | 0.66 | NOTUM (0.44) | NOTUMALDH1A1 | |
| SCHEMBL7026098 | 0.64 | ALDH1A1 (0.41) | KDM4EAPEX1ALDH1A1 | |
| SCHEMBL9046330 | 0.64 | PDE4D (0.33) | — | |
| SCHEMBL7017473 | 0.64 | — | — | |
| SCHEMBL7024852 | 0.63 | PTGER3 (0.41) | — | |
| SCHEMBL9268827 | 0.63 | ALDH1A1 (0.54) | ALDH1A1 | |
| SCHEMBL27299326 | 0.62 | KDM4E (0.54) | KDM4ECSNK2A1MYCNOTUMTPMT |
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 |
|---|---|---|---|---|---|---|---|
| CN-1143958-A | (4,4-difluorobut-3-enylthio-)-substituted heterocyclic or carbocyclic ring compounds | ZENECA LTD (GB) | 1997-02-26 | — | — | CN | disclosed |