Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.37 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL31228482 | 0.85 | ALDH1A1 (0.41) | TSHRALDH1A1CNR2TDP1POLB | |
| SCHEMBL421948 | 0.82 | POLB (0.41) | TSHRALDH1A1POLBKDM4E | |
| SCHEMBL421947 | 0.82 | POLB (0.41) | TSHRALDH1A1POLBKDM4E | |
| SCHEMBL11228448 | 0.81 | HDAC3 (0.41) | TSHRALDH1A1CNR2HTR2AHRH1 | |
| SCHEMBL11958059 | 0.79 | TSHR (0.42) | TSHRALDH1A1CNR2HTR2APOLB | |
| SCHEMBL9051157 | 0.78 | SIGMAR1 (0.48) | TSHRALDH1A1HTR2AHRH1AOC3 | |
| SCHEMBL11368675 | 0.76 | AOC3 (0.42) | TSHRALDH1A1CNR2AOC3 | |
| SCHEMBL15388464 | 0.76 | ALDH1A1 (0.45) | TSHRALDH1A1CNR2HTR2AHRH1 | |
| Hydrochloric Acid SCHEMBL3372149 | 0.76 | POLB (0.46) | TSHRALDH1A1CNR2AOC3POLB | |
| SCHEMBL5798284 | 0.74 | HDAC3 (0.46) | ALDH1A1HDAC3HDAC1HDAC2HDAC8 |
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-5106844-A | Imidazo[2,2-b][3]benzazepine and pyrimido[2,1-b][3]benzazepine antiarrhythmic agents | STERLING DRUG INC. (US) | 1992-04-21 | — | — | US | disclosed |