Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PER2 | O15055 | 6/20 | 0.40 |
| ▸ | CRY2 | Q49AN0 | 6/20 | 0.40 |
| ▸ | CRY1 | Q16526 | 4/20 | 0.40 |
| ▸ | HTR3A | P46098 | 5/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | ICMT | O60725 | 3/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | ASH1L | Q9NR48 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 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 | |
|---|---|---|---|---|
| SCHEMBL8959520 | 1.00 | PER2 (0.40) | PER2CRY2CRY1HTR3AHTR2A | |
| SCHEMBL9228920 | 0.85 | HTR2C (0.56) | HTR2AHTR2C | |
| SCHEMBL8959653 | 0.82 | ICMT (0.48) | PER2CRY2CRY1HTR3AICMT | |
| SCHEMBL8959663 | 0.82 | ICMT (0.48) | PER2CRY2CRY1HTR3AICMT | |
| SCHEMBL23927868 | 0.82 | HTR2C (0.38) | PER2CRY2CRY1HTR3AHTR2A | |
| SCHEMBL23927866 | 0.82 | HTR2C (0.38) | PER2CRY2CRY1HTR3AHTR2A | |
| SCHEMBL29780353 | 0.82 | HTR2C (0.38) | PER2CRY2CRY1HTR3AHTR2A | |
| SCHEMBL24824798 | 0.79 | CYP19A1 (0.44) | ICMTAR | |
| Fumaric Acid SCHEMBL8959743 | 0.78 | HTR2C (0.46) | HTR3AHTR2AHTR2CICMTAR | |
| Fumaric Acid SCHEMBL8959751 | 0.78 | HTR2C (0.46) | HTR3AHTR2AHTR2CICMTAR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1061341-C | 1-amino-ethylindole-derivatives | HOFFMANN LA ROCHE (CH) | 2001-01-31 | — | — | CN | disclosed |
| US-5494928-A | FOR CENTRAL NERVOUS SYSTEM DISORDERS, BLOCKING SEROTONIN RECEPTORS, ANTIDEPRESSANTS | HOFFMANN-LA ROCHE INC. (US) | 1996-02-27 | — | — | US | disclosed |
| CN-1105988-A | 1-amino-ethylindole-derivatives | HOFFMANN LA ROCHE (CH) | 1995-08-02 | — | — | CN | disclosed |
| EP-0655440-A2 | 1-Aminoethylindoles | F. HOFFMANN-LA ROCHE AG (CH) | 1995-05-31 | — | — | EP | disclosed |