Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTSR1 | P30989 | 8/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 2/20 | 0.33 |
| ▸ | HTR1B | P28222 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5220798 | 0.84 | HTR1D (0.42) | NTSR1HTR1AHTR7HTR1DHTR1B | |
| Hydrochloric Acid SCHEMBL28515535 | 0.82 | HTR1D (0.41) | NTSR1HTR1AHTR7HTR1DHTR1B | |
| Hydrochloric Acid SCHEMBL28502715 | 0.82 | HTR1D (0.41) | NTSR1HTR1AHTR7HTR1DHTR1B | |
| Hydrochloric Acid SCHEMBL28520193 | 0.80 | HTR1D (0.42) | NTSR1HTR1AHTR7HTR1DHTR1B | |
| SCHEMBL12554649 | 0.70 | NTSR1 (0.41) | NTSR1 | |
| SCHEMBL15818392 | 0.70 | HTR2C (0.59) | HTR1A | |
| Hydrochloric Acid SCHEMBL7666084 | 0.69 | HTR2C (0.61) | HTR1A | |
| SCHEMBL28855915 | 0.69 | HTR1A (0.42) | HTR1AHTR7HTR1DHTR1BADRA2A | |
| SCHEMBL25449113 | 0.68 | SLC18A3 (0.47) | HTR1ATRPA1 | |
| SCHEMBL8718210 | 0.67 | HTR2C (0.46) | — |
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-2019181564-A1 | POLYMER FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT | 日鉄ケミカル＆マテリアル株式会社 | 2019-09-26 | — | — | WO | disclosed |