Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 9/20 | 0.49 |
| ▸ | DRD3 | P35462 | 5/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.48 |
| ▸ | DRD1 | P21728 | 3/20 | 0.48 |
| ▸ | HTR2A | P28223 | 3/20 | 0.48 |
| ▸ | HTR2C | P28335 | 3/20 | 0.48 |
| ▸ | HTR3A | P46098 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.48 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.48 |
| ▸ | HTR6 | P50406 | 2/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.48 |
| ▸ | CNR1 | P21554 | 2/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL14475370 | 0.89 | DRD3 (0.63) | HRH1DRD3LMNACHRM2ADRA2A | |
| SCHEMBL14475366 | 0.85 | HRH1 (0.48) | HRH1DRD3LMNACHRM2ADRA2A | |
| SCHEMBL20978932 | 0.84 | HRH1 (0.50) | HRH1DRD3LMNACHRM2ADRA2A | |
| SCHEMBL20381752 | 0.83 | HRH1 (0.48) | HRH1DRD3LMNACHRM2ADRA2A | |
| SCHEMBL14474308 | 0.81 | HRH1 (0.63) | HRH1DRD3LMNACHRM2ADRA2A | |
| SCHEMBL14473930 | 0.81 | HRH1 (0.47) | HRH1DRD3LMNACHRM2ADRA2A | |
| SCHEMBL14474697 | 0.80 | DRD3 (0.48) | HRH1DRD3LMNACHRM2ADRA2A | |
| SCHEMBL20978793 | 0.80 | HRH1 (0.49) | HRH1DRD3CHRM2CHRM1HTR2A | |
| SCHEMBL14475372 | 0.74 | HRH1 (0.66) | HRH1DRD3LMNACHRM2ADRA2A | |
| SCHEMBL15663082 | 0.74 | HRH1 (0.62) | HRH1DRD3LMNACHRM2ADRA2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2727919-B1 | BENZOCYCLOHEPTANETHIOPHENE DERIVATIVES FOR ANTI-ALLERGIC REACTIONS | FUJIAN MINDONG REJUVENATION PHARMACEUTICAL CO LTD (CN) | 2019-05-08 | — | — | EP | disclosed |
| WO-2013000406-A1 | BENZOCYCLOHEPTANETHIOPHENE DERIVATIVES FOR ANTI-ALLERGIC REACTIONS | LIN TONGJUN (CN) | 2013-01-03 | — | — | WO | disclosed |