Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.55 |
| ▸ | HTR2C | P28335 | 3/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | FBP1 | P09467 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9562361 | 1.00 | MAOB (0.55) | MAOBHTR2CCYP1A2HDAC3ADAM17 | |
| Hydrochloric Acid SCHEMBL19994632 | 0.98 | HTR2C (0.54) | MAOBHTR2CCYP1A2HDAC3ADAM17 | |
| Hydrochloric Acid SCHEMBL19994635 | 0.98 | HTR2C (0.54) | MAOBHTR2CCYP1A2HDAC3ADAM17 | |
| Hydrochloric Acid SCHEMBL31556609 | 0.89 | MAOB (0.48) | MAOBHTR2CCYP1A2HDAC3ADAM17 | |
| Hydrochloric Acid SCHEMBL30836062 | 0.89 | MAOB (0.48) | MAOBHTR2CCYP1A2HDAC3ADAM17 | |
| SCHEMBL28339243 | 0.83 | MAOB (0.57) | MAOBCYP1A2HDAC3ADAM17HDAC1 | |
| SCHEMBL27401595 | 0.83 | MAOB (0.50) | MAOBCYP1A2HDAC3ADAM17HDAC1 | |
| SCHEMBL20015392 | 0.81 | MAOB (0.58) | MAOBHTR2CFBP1 | |
| SCHEMBL5213208 | 0.81 | MAOB (0.51) | MAOB | |
| SCHEMBL6011005 | 0.80 | EPHX1 (0.45) | MAOBHTR2CHDAC1HDAC8HRH3 |
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-0524846-A1 | 2-(Piperidin-1-yl)ethanol derivatives, their preparation and their use in therapeutics | SYNTHELABO (FR) | 1993-01-27 | — | — | EP | disclosed |