Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 2/20 | 0.39 |
| ▸ | DRD5 | P21918 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8747203 | 0.96 | PKM (0.47) | PKMMEN1KMT2AMAOATSHR | |
| SCHEMBL8747047 | 0.88 | MEN1 (0.48) | PKMMEN1KMT2AMAOATSHR | |
| SCHEMBL8747353 | 0.83 | HTR2C (0.45) | PKMMEN1KMT2AMAOATSHR | |
| SCHEMBL8746992 | 0.83 | MEN1 (0.46) | PKMMEN1KMT2AHTR2AHTR2C | |
| Bromide SCHEMBL8747077 | 0.82 | MEN1 (0.45) | PKMMEN1KMT2AHTR2AHTR2C | |
| SCHEMBL7423986 | 0.80 | PKM (0.45) | PKMMEN1KMT2AMAOATSHR | |
| SCHEMBL8747147 | 0.80 | PKM (0.46) | PKMMEN1KMT2AHTR2AHTR2C | |
| SCHEMBL8549915 | 0.78 | PKM (0.46) | PKMMEN1KMT2AMAOATSHR | |
| SCHEMBL7419953 | 0.78 | PKM (0.46) | PKMMEN1KMT2AMAOATSHR | |
| SCHEMBL8747075 | 0.78 | MAOA (0.43) | MAOADRD1DRD5HSD17B10ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0618900-B1 | SUBSTITUTED TETRAHYDROISOQUINOLINES AND THEIR USE AS THERAPEUTIC AGENTS | KNOLL AG (DE) | 1997-03-12 | — | — | EP | disclosed |
| US-5519034-A | ANALGESICS | THE BOOTS COMPANY PLC (GB) | 1996-05-21 | — | — | US | disclosed |
| EP-0618900-A1 | SUBSTITUTED TETRAHYDROISOQUINOLINES AND THEIR USE AS THERAPEUTIC AGENTS. | BOOTS CO PLC (GB) | 1994-10-12 | — | — | EP | disclosed |
| WO-1993013073-A1 | SUBSTITUTED TETRAHYDROISOQUINOLINES AND THEIR USE AS THERAPEUTIC AGENTS | THE BOOTS COMPANY PLC (GB) | 1993-07-08 | — | — | WO | disclosed |