Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Hordenine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.48 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.45 |
| ▸ | ESRRG | P62508 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | CDC25C | P30307 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | F13A1 | P00488 | 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 | |
|---|---|---|---|---|
| Hordenine SCHEMBL36798 | 0.87 | HRH3 (0.67) | HRH3TAAR1ESR1ESR2KDM4E | |
| Hordenine SCHEMBL19896488 | 0.87 | HRH3 (0.67) | HRH3TAAR1ESR1ESR2KDM4E | |
| Hordenine SCHEMBL2478680 | 0.85 | HRH3 (0.64) | HRH3TAAR1ESR1ESR2KDM4E | |
| Hordenine SCHEMBL11147428 | 0.85 | HRH3 (0.64) | HRH3TAAR1ESR1ESR2KDM4E | |
| Hordenine SCHEMBL28644842 | 0.83 | HRH3 (0.61) | HRH3TAAR1ESR1ESR2ESRRG | |
| Hordenine SCHEMBL6338584 | 0.81 | HRH3 (0.55) | HRH3TAAR1ESR1ESR2ESRRG | |
| Hordenine SCHEMBL18329336 | 0.81 | HRH3 (0.55) | HRH3TAAR1ESR1ESR2ESRRG | |
| SCHEMBL777298 | 0.78 | KCNH2 (0.60) | HRH3TAAR1CDC25CKCNH2SIGMAR1 | |
| SCHEMBL18762839 | 0.76 | HRH3 (0.84) | HRH3TAAR1KCNH2SIGMAR1 | |
| Nitric Acid SCHEMBL18329335 | 0.75 | TMEM97 (0.75) | TAAR1ESR1ESR2ESRRGKDM4E |
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-9526793-B1 | Salts of phenylethylamines and inorganic acids and methods of use thereof | KRAMER RONALD (US) | 2016-12-27 | — | — | US | disclosed |