Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 11/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5527594 | 0.70 | KDM1A (0.39) | KDM4ESLC6A4SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL15814919 | 0.69 | KDM4E (0.46) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL28025942 | 0.68 | KDM4E (0.45) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL25193025 | 0.66 | KDM4E (0.39) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL15954534 | 0.66 | KDM4E (0.39) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL25190326 | 0.66 | KDM4E (0.39) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL7849802 | 0.65 | KDM4E (0.41) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL27999787 | 0.64 | KDM4E (0.41) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL25477018 | 0.62 | KDM4E (0.39) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL5405317 | 0.60 | SLC6A4 (0.59) | KDM4ESLC6A4SLC6A2SLC6A3CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5739385-A | OXIDIZING AN OPTICALLY ACTIVE ALDEHYDE WITH A PERACID IN THE PRESENCE OF AN AMINE AND/OR AMINE N-OXIDE CATALYST | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 1998-04-14 | — | — | US | disclosed |