Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.38 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1573628 | 0.98 | CYP2D6 (0.45) | CYP2D6MEN1CYP3A4KMT2AHTR2A | |
| SCHEMBL11846170 | 0.94 | MEN1 (0.46) | CYP2D6MEN1CYP3A4KMT2AHTR2A | |
| SCHEMBL19158572 | 0.87 | MEN1 (0.49) | CYP2D6MEN1CYP3A4KMT2AHTR2A | |
| SCHEMBL1248364 | 0.84 | BCHE (0.41) | CYP2D6MEN1CYP3A4KMT2ABCHE | |
| SCHEMBL4540545 | 0.84 | HTR2C (0.54) | CYP2D6HTR2ABCHEHTR2C | |
| SCHEMBL26201345 | 0.80 | MEN1 (0.51) | CYP2D6MEN1CYP3A4KMT2AHTR2A | |
| SCHEMBL17121746 | 0.80 | MEN1 (0.51) | CYP2D6MEN1CYP3A4KMT2AHTR2A | |
| SCHEMBL17120414 | 0.80 | MEN1 (0.51) | CYP2D6MEN1CYP3A4KMT2AHTR2A | |
| SCHEMBL20227872 | 0.78 | CYP2D6 (0.41) | CYP2D6MEN1CYP3A4KMT2AHTR2A | |
| SCHEMBL29700481 | 0.78 | MEN1 (0.49) | CYP2D6MEN1CYP3A4KMT2AHTR2A |
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-3961062-A | Pharmaceutical composition containing 1-(imidazole-1-yl)-isoquinolines and method of treating hyperlipemia | HOECHST AKTIENGESELLSCHAFT (DT) | 1976-06-01 | — | — | US | disclosed |