Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.48 |
| ▸ | HTR2C | P28335 | 2/20 | 0.48 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | KRAS | P01116 | 1/20 | 0.32 |
| ▸ | ICMT | O60725 | 2/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.31 |
| ▸ | PGR | P06401 | 2/20 | 0.31 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8959557 | 1.00 | HTR2A (0.48) | HTR2AHTR2CARKRASICMT | |
| SCHEMBL8959643 | 0.85 | AR (0.33) | HTR2AHTR2CARGRIN2BNR3C1 | |
| SCHEMBL8959695 | 0.84 | HTR2A (0.36) | HTR2AHTR2CGRIN2B | |
| SCHEMBL27447136 | 0.82 | AR (0.34) | HTR2AHTR2CAR | |
| SCHEMBL8959696 | 0.82 | AR (0.34) | HTR2AHTR2CAR | |
| SCHEMBL8959909 | 0.79 | ICMT (0.32) | ICMT | |
| SCHEMBL27524962 | 0.79 | HTR2A (0.46) | HTR2AHTR2CARKRAS | |
| SCHEMBL8959588 | 0.79 | HTR2A (0.46) | HTR2AHTR2CARKRAS | |
| SCHEMBL8959561 | 0.79 | HTR2A (0.49) | HTR2AHTR2CARKRASGRIN2B | |
| SCHEMBL8959864 | 0.79 | HTR2A (0.49) | HTR2AHTR2CARKRASGRIN2B |
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 3 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 |