Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ICMT | O60725 | 4/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.33 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TNF | P01375 | 1/20 | 0.32 |
| ▸ | PLK1 | P53350 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8959672 | 1.00 | ICMT (0.40) | ICMTHTR2AHTR2CKCNH2MAP2K1 | |
| SCHEMBL9232667 | 0.86 | HTR2C (0.56) | ICMTHTR2AHTR2CKCNH2TNF | |
| Fumaric Acid SCHEMBL8959914 | 0.81 | HTR2A (0.47) | ICMTHTR2AHTR2CTNF | |
| Fumaric Acid SCHEMBL8959900 | 0.81 | HTR2A (0.47) | ICMTHTR2AHTR2CTNF | |
| Fumaric Acid SCHEMBL27340852 | 0.81 | HTR2A (0.47) | ICMTHTR2AHTR2CTNF | |
| SCHEMBL8959510 | 0.73 | ICMT (0.45) | ICMTHTR2AHTR2CKCNH2KDM4E | |
| SCHEMBL8959513 | 0.73 | ICMT (0.45) | ICMTHTR2AHTR2CKCNH2KDM4E | |
| SCHEMBL8959653 | 0.72 | ICMT (0.48) | ICMTKCNH2 | |
| SCHEMBL8959663 | 0.72 | ICMT (0.48) | ICMTKCNH2 | |
| SCHEMBL8959770 | 0.71 | HTR2C (0.74) | ICMTHTR2AHTR2CKCNH2KDM4E |
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 |