Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 6/20 | 0.45 |
| ▸ | HTR6 | P50406 | 5/20 | 0.45 |
| ▸ | DRD3 | P35462 | 4/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.45 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.45 |
| ▸ | DRD1 | P21728 | 2/20 | 0.45 |
| ▸ | HTR2A | P28223 | 2/20 | 0.45 |
| ▸ | HTR2C | P28335 | 2/20 | 0.45 |
| ▸ | HTR3A | P46098 | 2/20 | 0.45 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14473932 | 0.88 | HRH1 (0.62) | HRH1HTR6DRD3CHRM4LMNA | |
| SCHEMBL14475372 | 0.74 | HRH1 (0.66) | HRH1HTR6DRD3CHRM4LMNA | |
| SCHEMBL15663082 | 0.74 | HRH1 (0.62) | HRH1HTR6DRD3CHRM4LMNA | |
| SCHEMBL15663042 | 0.73 | HRH1 (0.62) | HRH1HTR6DRD3CHRM4LMNA | |
| SCHEMBL14475367 | 0.72 | HRH1 (0.63) | HRH1HTR6DRD3CHRM4LMNA | |
| SCHEMBL14474694 | 0.72 | HRH1 (0.43) | HRH1HTR6DRD3CHRM4LMNA | |
| SCHEMBL20978776 | 0.71 | HRH1 (0.47) | HRH1HTR6DRD3CHRM4LMNA | |
| SCHEMBL20978787 | 0.71 | HRH1 (0.53) | HRH1HTR6DRD3CHRM4LMNA | |
| SCHEMBL14474308 | 0.70 | HRH1 (0.63) | HRH1HTR6DRD3CHRM4LMNA | |
| SCHEMBL14473931 | 0.70 | HRH1 (0.63) | HRH1HTR6DRD3CHRM4LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2727919-B1 | BENZOCYCLOHEPTANETHIOPHENE DERIVATIVES FOR ANTI-ALLERGIC REACTIONS | FUJIAN MINDONG REJUVENATION PHARMACEUTICAL CO LTD (CN) | 2019-05-08 | — | — | EP | disclosed |