Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 13/20 | 0.60 |
| ▸ | BCHE | P06276 | 8/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.60 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.60 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.60 |
| ▸ | BLM | P54132 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.60 |
| ▸ | TP53 | P04637 | 2/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.60 |
| ▸ | MTOR | P42345 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL9541053 | 1.00 | ACHE (0.60) | ACHEBCHEKDM4ECYP2D6MEN1 | |
| Fumaric Acid SCHEMBL9537901 | 0.91 | KDM4E (0.67) | ACHEBCHEKDM4ECYP2D6MEN1 | |
| Fumaric Acid SCHEMBL9537896 | 0.91 | KDM4E (0.67) | ACHEBCHEKDM4ECYP2D6MEN1 | |
| SCHEMBL2732498 | 0.89 | ACHE (0.67) | ACHEBCHEKDM4ECYP2D6MEN1 | |
| SCHEMBL8827788 | 0.89 | ACHE (0.67) | ACHEBCHEKDM4ECYP2D6MEN1 | |
| SCHEMBL8321657 | 0.86 | ACHE (0.69) | ACHEBCHEKDM4ECYP2D6MEN1 | |
| SCHEMBL5025942 | 0.86 | ACHE (0.69) | ACHEBCHEKDM4ECYP2D6MEN1 | |
| SCHEMBL12082976 | 0.86 | ACHE (0.69) | ACHEBCHEKDM4ECYP2D6MEN1 | |
| SCHEMBL9206921 | 0.80 | ACHE (0.79) | ACHEBCHEKDM4ECYP2D6MEN1 | |
| SCHEMBL9206926 | 0.80 | ACHE (0.79) | ACHEBCHEKDM4ECYP2D6MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5187165-A | Eseroline derivatives; cholinergic agents; antidepressants | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1993-02-16 | — | — | US | disclosed |