Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.47 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 5/20 | 0.44 |
| ▸ | CASP3 | P42574 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.38 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | NPY1R | P25929 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6072764 | 0.83 | HRH1 (0.65) | HRH1CYP2D6CHRM1KCNH2 | |
| SCHEMBL6072802 | 0.83 | HRH3 (0.57) | TAS1R3TAS1R1HRH1CASP3HRH3 | |
| SCHEMBL6072759 | 0.80 | HRH1 (0.58) | TAS1R3TAS1R1HRH1CYP2D6CHRM1 | |
| SCHEMBL6072979 | 0.80 | HRH1 (0.45) | TAS1R3TAS1R1HRH1CASP3CYP2D6 | |
| SCHEMBL6072732 | 0.80 | HRH1 (0.58) | TAS1R3TAS1R1HRH1CYP2D6CHRM1 | |
| SCHEMBL6073268 | 0.79 | HRH1 (0.52) | TAS1R3TAS1R1HRH1CYP2D6CHRM1 | |
| SCHEMBL6073337 | 0.77 | HRH1 (0.47) | HRH1CYP2D6CHRM1KCNH2NPY1R | |
| SCHEMBL6072778 | 0.77 | HRH1 (0.43) | TAS1R3TAS1R1HRH1CYP2D6CHRM1 | |
| SCHEMBL6072713 | 0.75 | HRH1 (0.43) | TAS1R3TAS1R1HRH1CYP2D6CHRM1 | |
| SCHEMBL24490 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006019497-A2 | SLEEP-INDUCING COMPOUNDS AND METHODS RELATED THERETO | NEUROCRINE BIOSCIENCES, INC. (US) | 2006-02-23 | — | — | WO | disclosed |