Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | PDE2A | O00408 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL3998220 | 0.84 | LMNA (0.41) | LMNAADRB2ADRB1CYP2D6NFKB1 | |
| SCHEMBL7145812 | 0.82 | AOC3 (0.40) | ADRB2ADRB1CYP2D6NFKB1HIF1A | |
| SCHEMBL8760976 | 0.82 | LMNA (0.47) | LMNAADRB2ADRB1CYP2D6NFKB1 | |
| SCHEMBL6055159 | 0.82 | LMNA (0.47) | LMNAADRB2ADRB1CYP2D6NFKB1 | |
| SCHEMBL28565247 | 0.81 | PDE2A (0.49) | LMNATSHRPDE2ACYP1A2CYP3A4 | |
| SCHEMBL30172716 | 0.79 | LMNA (0.61) | LMNAADRB2ADRB1CYP2D6NFKB1 | |
| SCHEMBL5107136 | 0.79 | LMNA (0.61) | LMNAADRB2ADRB1CYP2D6NFKB1 | |
| SCHEMBL5107133 | 0.79 | LMNA (0.61) | LMNAADRB2ADRB1CYP2D6NFKB1 | |
| SCHEMBL5107130 | 0.79 | LMNA (0.61) | LMNAADRB2ADRB1CYP2D6NFKB1 | |
| SCHEMBL16064818 | 0.78 | ADRB2 (0.59) | LMNAADRB2ADRB1CYP2D6NFKB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0779261-A1 | Continuous process for racemization of benzylic alcohols, ethers, and esters by solid acid catalyst | UOP (US) | 1997-06-18 | — | — | EP | disclosed |
| US-5476964-A | Heating and flowing enamtiomorph through acidic ion exchange resin; recycling wastes | UOP (US) | 1995-12-19 | — | — | US | disclosed |