Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.43 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.43 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.43 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.43 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.43 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.43 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8919693 | 0.88 | POLB (0.46) | ALDH1A1MAPTAPPKMT2AKDM4E | |
| SCHEMBL8920278 | 0.83 | MEN1 (0.51) | ALDH1A1CYP3A4CYP2D6MAPK1CYP2C19 | |
| SCHEMBL8629045 | 0.83 | ALDH1A1 (0.41) | ALDH1A1MAPTMAPK1APPKMT2A | |
| SCHEMBL8919157 | 0.82 | ALDH1A1 (0.35) | ALDH1A1MAPTKMT2AKDM4EHPGD | |
| SCHEMBL8921274 | 0.81 | ALDH1A1 (0.45) | ALDH1A1CYP3A4CYP2D6MAPTMAPK1 | |
| SCHEMBL8918109 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CYP3A4CYP2D6MAPTMAPK1 | |
| SCHEMBL8919198 | 0.78 | POLB (0.47) | ALDH1A1MAPTKDM4ETP53POLB | |
| SCHEMBL8918497 | 0.77 | DRD4 (0.53) | ALDH1A1KMT2A | |
| SCHEMBL8917897 | 0.75 | SIGMAR1 (0.42) | ALDH1A1MAPK1KDM4EL3MBTL1HPGD | |
| SCHEMBL8919081 | 0.74 | PDE1B (0.41) | ALDH1A1TSHRKDM4EHPGD |
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-5618819-A | ANALGESICS | ADIR ET COMPAGNIE (FR) | 1997-04-08 | — | — | US | disclosed |
| EP-0691339-A1 | Amine derivatives of 1,3-dihydro-2H-pyrrolo(2,3-b)pyridin-2-ones and oxazolo(4,5-b)pyridin-2(3H)-ones, their process of preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1996-01-10 | — | — | EP | disclosed |