Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.34 |
| ▸ | MTOR | P42345 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | MYLK | Q15746 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 5/20 | 0.33 |
| ▸ | HTR7 | P34969 | 4/20 | 0.33 |
| ▸ | HTR1A | P08908 | 3/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.33 |
| ▸ | HTR3A | P46098 | 3/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | HTR5A | P47898 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28290840 | 0.77 | HTR6 (0.39) | MGLLADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL28030551 | 0.77 | MEN1 (0.41) | MGLLADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL28030529 | 0.77 | ADRB1 (0.56) | MGLLADRB1CYP1A2CYP2D6CYP3A4 | |
| SCHEMBL28030092 | 0.77 | ADRB1 (0.58) | MGLLADRB1CYP1A2CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL5766987 | 0.76 | ADRB1 (0.56) | MGLLADRB1CYP1A2CYP2D6TSHR | |
| SCHEMBL28030099 | 0.74 | HTR6 (0.59) | CYP1A2CYP2D6TSHRNFKB1MTOR | |
| SCHEMBL28290905 | 0.74 | ALOX5 (0.59) | MGLLADRB1TSHRHTR1AALOX5 | |
| SCHEMBL23064494 | 0.73 | HTR1A (0.42) | ADRB1HTR6HTR1AALOX5HTR2A | |
| SCHEMBL28030100 | 0.73 | NCF1 (0.46) | ADRB1HTR6HTR1AALOX5HTR2A | |
| SCHEMBL28290843 | 0.73 | FAAH (0.42) | MGLLADRB1CYP2C19HTR6ALOX5 |
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-0199997-A2 | Process for preparing diaryl-pentaerythritol | ADEKA ARGUS CHEMICAL CO., Ltd. (JP) | 1986-11-05 | — | — | EP | disclosed |