Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 5/20 | 0.56 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.43 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | RXRB | P28702 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9812089 | 1.00 | ABCB1 (0.56) | ABCB1PLA2G4BMAOBPOLBPKM | |
| SCHEMBL9811990 | 1.00 | ABCB1 (0.56) | ABCB1PLA2G4BMAOBPOLBPKM | |
| SCHEMBL9683688 | 0.92 | ABCB1 (0.55) | ABCB1MAOBPOLBALDH1A1MAPT | |
| SCHEMBL9683677 | 0.92 | ABCB1 (0.55) | ABCB1MAOBPOLBALDH1A1MAPT | |
| SCHEMBL9812016 | 0.91 | ABCB1 (0.54) | ABCB1MAOBPOLBGAATSHR | |
| SCHEMBL9812027 | 0.91 | ABCB1 (0.54) | ABCB1MAOBPOLBGAATSHR | |
| SCHEMBL9683362 | 0.90 | GAA (0.59) | ABCB1GAATSHRCYP2D6ALDH1A1 | |
| SCHEMBL9811937 | 0.90 | GAA (0.59) | ABCB1GAATSHRCYP2D6ALDH1A1 | |
| SCHEMBL9685205 | 0.90 | GAA (0.59) | ABCB1GAATSHRCYP2D6ALDH1A1 | |
| SCHEMBL9811936 | 0.90 | GAA (0.59) | ABCB1GAATSHRCYP2D6ALDH1A1 |
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-0170121-B1 | 2-HYDROXY-3-ARYLOXYPROPYL OR 2-HYDROXY-2-BENZOFURANYL ETHYL TERTIARY AMINE HAVING AN ANTI-HYPERGLYCAEMIC AND/OR ANTI-OBESITY ACTIVITY | BEECHAM GROUP PLC (GB) | 1991-06-19 | — | — | EP | claimed |