Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 17/20 | 0.74 |
| ▸ | HTR2A | P28223 | 15/20 | 0.74 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | HTR2B | P41595 | 1/20 | 0.66 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8959844 | 1.00 | HTR2C (0.74) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959579 | 0.94 | HTR2C (0.74) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959583 | 0.94 | HTR2C (0.74) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959895 | 0.94 | HTR2C (0.74) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959535 | 0.88 | HTR2C (0.71) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959539 | 0.88 | HTR2C (0.71) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8959648 | 0.88 | HTR2C (0.71) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9232946 | 0.85 | HTR2C (1.00) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL15307684 | 0.82 | HTR2C (0.78) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL18305472 | 0.80 | HTR2C (0.66) | HTR2CHTR2ACYP1A2CYP3A4CYP2C9 |
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 |