Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 4/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3756230 | 0.85 | CYP3A4 (0.38) | BCHEMAOBCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL3756225 | 0.85 | CYP3A4 (0.38) | BCHEMAOBCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL3757483 | 0.85 | CYP3A4 (0.38) | BCHEMAOBCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL11124160 | 0.77 | CHRNB2 (0.49) | BCHEMAOBCYP3A4CYP1A2CYP2D6 | |
| Formic Acid SCHEMBL31266947 | 0.76 | DRD2 (0.35) | CYP3A4CYP1A2CYP2D6DRD2DRD3 | |
| Biphenyl SCHEMBL7588601 | 0.75 | CYP3A4 (0.49) | BCHEMAOBCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL7588607 | 0.74 | CYP2D6 (0.73) | BCHEMAOBCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL11268839 | 0.73 | DRD3 (0.41) | DRD2DRD3 | |
| SCHEMBL10593124 | 0.73 | DRD2 (0.35) | CYP3A4CYP1A2CYP2D6DRD2DRD3 | |
| SCHEMBL3839597 | 0.71 | SLC6A11 (0.52) | CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5952506-A | Process for the synthesis of 4- 6- (hexylcarbamoyloxy) hexylcarbamoyloxy!-piperidine-1-carboxylic acid 4-phenoxyphenyl ester | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-09-14 | — | — | US | disclosed |
| WO-1998047870-A1 | PROCESS FOR THE SYNTHESIS OF 4-[6-(HEXYLCARBAMOYLOXY) HEXYLCARBAMOYLOXY]-PIPERIDINE-1- CARBOXYLIC ACID 4-PHENOXYPHENYL ESTER | AMERICAN HOME PRODUCTS CORPORATION (US) | 1998-10-29 | — | — | WO | disclosed |