Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.33 |
| ▸ | SCD | O00767 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21195144 | 1.00 | CYP1A2 (0.38) | CYP1A2CYP2D6MEN1KMT2ADRD4 | |
| SCHEMBL11138036 | 0.93 | MEN1 (0.39) | CYP1A2CYP2D6MEN1KMT2ADRD4 | |
| SCHEMBL28300124 | 0.93 | MEN1 (0.39) | CYP1A2CYP2D6MEN1KMT2ADRD4 | |
| SCHEMBL9787947 | 0.93 | MEN1 (0.39) | CYP1A2CYP2D6MEN1KMT2ADRD4 | |
| SCHEMBL4665795 | 0.93 | MEN1 (0.39) | CYP1A2CYP2D6MEN1KMT2ADRD4 | |
| SCHEMBL5613182 | 0.91 | CYP1A2 (0.39) | CYP1A2CYP2D6MEN1KMT2ADRD4 | |
| SCHEMBL9220992 | 0.91 | MGLL (0.38) | — | |
| Ethylene SCHEMBL27432416 | 0.90 | MEN1 (0.38) | CYP1A2CYP2D6MEN1KMT2ADRD4 | |
| SCHEMBL6141492 | 0.88 | CYP1A2 (0.36) | CYP1A2CYP2D6MEN1KMT2ADRD4 | |
| SCHEMBL15476247 | 0.88 | CYP1A2 (0.36) | CYP1A2CYP2D6MEN1KMT2ADRD4 |
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-5030629-A | Transdermal Administration Of Cardiovascular Agents | THERAPEUTIC PATCH RESEARCH N.V. | 1991-07-09 | — | — | US | disclosed |