Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7135404 | 1.00 | HRH3 (0.39) | HRH3HTR2AHTR2CHTR2BALDH1A1 | |
| SCHEMBL7135377 | 0.86 | HDAC6 (0.42) | HTR2AHTR2CHTR2BALDH1A1GBA1 | |
| SCHEMBL8032476 | 0.86 | ALDH1A1 (0.42) | HRH3ALDH1A1ACHEKDM4E | |
| SCHEMBL11403821 | 0.81 | CDC25A (0.39) | HTR2AHTR2CHTR2BALDH1A1KDM4E | |
| SCHEMBL11400396 | 0.81 | CDC25A (0.39) | HTR2AHTR2CHTR2BALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL11392940 | 0.80 | CDC25A (0.39) | HTR2AHTR2CHTR2BALDH1A1SIGMAR1 | |
| SCHEMBL22132288 | 0.78 | HTR2C (0.38) | HTR2AHTR2CHTR2BHRH1 | |
| SCHEMBL22132289 | 0.78 | HTR2C (0.38) | HTR2AHTR2CHTR2BHRH1 | |
| SCHEMBL15999467 | 0.76 | HTR2C (0.42) | HTR2AHTR2CHTR2BHRH1 | |
| SCHEMBL7140355 | 0.76 | HTR2C (0.42) | HTR2AHTR2CHTR2BHRH1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0902684-A1 | HEXAHYDRO-PYRIDO(4,3-B)INDOLE DERIVATIVES AS ANTIPSYCHOTIC DRUGS | JANSSEN PHARMACEUTICA N.V. (BE) | 1999-03-24 | — | — | EP | disclosed |
| WO-1997044040-A1 | HEXAHYDRO-PYRIDO(4,3-B)INDOLE DERIVATIVES AS ANTIPSYCHOTIC DRUGS | JANSSEN PHARMACEUTICA N.V. (BE) | 1997-11-27 | — | — | WO | disclosed |