Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8747267 | 0.83 | CHRNA7 (0.46) | ADRA1DADRA1AADRA1B | |
| Hydrochloric Acid SCHEMBL8747265 | 0.83 | CHRNA7 (0.46) | ADRA1DADRA1AADRA1B | |
| SCHEMBL8747147 | 0.80 | PKM (0.46) | PKMKMT2AMEN1SLC6A9 | |
| SCHEMBL8747329 | 0.79 | PKM (0.45) | PKMKMT2AMEN1ADRA1DADRA1A | |
| Hydrochloric Acid SCHEMBL8747055 | 0.78 | PKM (0.54) | PKMKMT2AMEN1MAOASLC6A9 | |
| SCHEMBL8747338 | 0.78 | PKM (0.44) | PKMKMT2AMEN1 | |
| SCHEMBL8746992 | 0.76 | MEN1 (0.46) | PKMKMT2AMEN1 | |
| SCHEMBL8747118 | 0.76 | PKM (0.54) | PKMKMT2AMEN1MAOASLC6A9 | |
| Bromide SCHEMBL8747077 | 0.76 | MEN1 (0.45) | PKMKMT2AMEN1 | |
| SCHEMBL8747149 | 0.75 | MEN1 (0.44) | PKMKMT2AMEN1 |
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 |