Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 5/20 | 0.39 |
| ▸ | ABAT | P80404 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2290799 | 0.89 | HRH3 (0.50) | HRH3LOXL2ABATAPPCA12 | |
| Hydrochloric Acid SCHEMBL28318930 | 0.87 | HRH3 (0.48) | HRH3LOXL2ABATAPPCA12 | |
| SCHEMBL17619352 | 0.83 | HRH3 (0.64) | HRH3LOXL2ABATAPPCA12 | |
| SCHEMBL28000087 | 0.81 | HTR6 (0.44) | LOXL2NOS3NOS1NOS2DDB1 | |
| Magnesium Chloride Anhydrous SCHEMBL28044650 | 0.81 | HRH3 (0.42) | HRH3LOXL2ABATAPPCA12 | |
| SCHEMBL12973295 | 0.78 | APP (0.57) | APP | |
| SCHEMBL291602 | 0.71 | ALDH1A1 (0.52) | APPCA12CA1CA2TSHR | |
| SCHEMBL7018335 | 0.71 | TAAR1 (0.56) | LOXL2TAAR1ADRA2ANOS3NOS1 | |
| SCHEMBL20027987 | 0.71 | HRH3 (0.46) | HRH3LOXL2ABATCA12CA1 | |
| SCHEMBL21238989 | 0.69 | POLB (0.66) | TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-105829285-A | Quinazolinone and isoquinolinone derivatives | 中外制药株式会社 | 2016-08-03 | — | — | CN | disclosed |