Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | KRAS | P01116 | 8/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.42 |
| ▸ | FABP4 | P15090 | 2/20 | 0.38 |
| ▸ | FABP3 | P05413 | 1/20 | 0.38 |
| ▸ | FABP2 | P12104 | 1/20 | 0.38 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27340857 | 1.00 | HTR2A (0.46) | HTR2AHTR2CKRASARNTSR1 | |
| SCHEMBL27342171 | 0.87 | HTR2C (0.45) | HTR2AHTR2CFABP4MCL1HDAC8 | |
| SCHEMBL8959547 | 0.87 | HTR2C (0.45) | HTR2AHTR2CFABP4MCL1HDAC8 | |
| SCHEMBL8959588 | 0.86 | HTR2A (0.46) | HTR2AHTR2CKRASARHDAC8 | |
| SCHEMBL8959678 | 0.86 | HTR2C (0.46) | HTR2AHTR2CARFABP4HDAC8 | |
| SCHEMBL8959479 | 0.86 | HTR2C (0.46) | HTR2AHTR2CARFABP4HDAC8 | |
| SCHEMBL27524962 | 0.86 | HTR2A (0.46) | HTR2AHTR2CKRASARHDAC8 | |
| SCHEMBL8959608 | 0.82 | HTR2A (0.45) | HTR2AHTR2CARHDAC6HDAC1 | |
| SCHEMBL8959581 | 0.80 | HTR2A (0.45) | HTR2AHTR2CFABP4HTR7MCL1 | |
| SCHEMBL27528051 | 0.80 | HTR2A (0.45) | HTR2AHTR2CFABP4HTR7MCL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5494928-A | FOR CENTRAL NERVOUS SYSTEM DISORDERS, BLOCKING SEROTONIN RECEPTORS, ANTIDEPRESSANTS | HOFFMANN-LA ROCHE INC. (US) | 1996-02-27 | — | — | US | disclosed |