Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 10/20 | 0.71 |
| ▸ | HTR2A | P28223 | 9/20 | 0.71 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.54 |
| ▸ | CDK4 | P11802 | 1/20 | 0.44 |
| ▸ | CCND1 | P24385 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8959717 | 1.00 | HTR2C (0.71) | HTR2CHTR2APRMT5CDK4CCND1 | |
| SCHEMBL8959657 | 0.87 | HTR2C (0.71) | HTR2CHTR2APRMT5KDM4EHPGD | |
| SCHEMBL8959650 | 0.87 | HTR2C (0.71) | HTR2CHTR2APRMT5KDM4EHPGD | |
| SCHEMBL13283050 | 0.86 | HTR2C (0.76) | HTR2CHTR2APRMT5CDK4CCND1 | |
| SCHEMBL9233993 | 0.83 | HTR2C (1.00) | HTR2CHTR2APRMT5CYP1A2CYP3A4 | |
| SCHEMBL9233990 | 0.83 | HTR2C (1.00) | HTR2CHTR2APRMT5CYP1A2CYP3A4 | |
| SCHEMBL8959781 | 0.82 | HTR2C (0.72) | HTR2CHTR2APRMT5CDK4CCND1 | |
| SCHEMBL8959491 | 0.82 | HTR2C (0.72) | HTR2CHTR2APRMT5CDK4CCND1 | |
| SCHEMBL8959569 | 0.82 | HTR2C (0.72) | HTR2CHTR2APRMT5 | |
| SCHEMBL8959574 | 0.82 | HTR2C (0.72) | HTR2CHTR2APRMT5 |
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 |