Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 4/20 | 0.42 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | HTR2B | P41595 | 3/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29613747 | 0.86 | HTR2C (0.42) | HTR2CHTR2AHTR2BSIGMAR1CHRNB2 | |
| SCHEMBL1047199 | 0.86 | HTR2C (0.42) | HTR2CHTR2AHTR2BSIGMAR1CHRNB2 | |
| SCHEMBL9307226 | 0.84 | SIGMAR1 (0.50) | HTR2CHTR2AHTR2BSIGMAR1TAAR1 | |
| SCHEMBL691797 | 0.84 | MEN1 (0.49) | HTR2CHTR2AHTR2BTAAR1 | |
| SCHEMBL9307221 | 0.84 | SIGMAR1 (0.50) | HTR2CHTR2AHTR2BSIGMAR1TAAR1 | |
| SCHEMBL9307217 | 0.84 | SIGMAR1 (0.50) | HTR2CHTR2AHTR2BSIGMAR1TAAR1 | |
| SCHEMBL1897659 | 0.83 | HTR2C (0.59) | HTR2CHTR2AHTR2BSIGMAR1CHRNB2 | |
| SCHEMBL9278829 | 0.83 | HTR2C (0.59) | HTR2CHTR2AHTR2BSIGMAR1CHRNB2 | |
| Hydrochloric Acid SCHEMBL9672275 | 0.81 | HTR2C (0.57) | HTR2CHTR2AHTR2BSIGMAR1CHRNB2 | |
| SCHEMBL7382531 | 0.81 | SIGMAR1 (0.49) | HTR2CHTR2AHTR2BSIGMAR1TAAR1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0422134-A4 | 5-HT SELECTIVE AGENTS | — | 1992-05-06 | — | — | EP | claimed |
| US-5254561-A | Tricyclic antipsychotic agents | MERCK SHARP & DOHME LIMITED (GB) | 1993-10-19 | — | — | US | disclosed |
| US-5254561-A | Tricyclic antipsychotic agents | MERCK SHARP & DOHME LIMITED (GB) | 1993-10-19 | — | — | US | disclosed |
| EP-0463691-A2 | Tricyclic sigma ligands | MERCK SHARP & DOHME LTD. (GB) | 1992-01-02 | — | — | EP | disclosed |
| EP-0463691-A2 | Tricyclic sigma ligands | MERCK SHARP & DOHME LTD. (GB) | 1992-01-02 | — | — | EP | disclosed |