Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 5/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.39 |
| ▸ | HTR1A | P08908 | 3/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.39 |
| ▸ | DRD1 | P21728 | 3/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 3/20 | 0.39 |
| ▸ | THPO | P40225 | 3/20 | 0.39 |
| ▸ | MTOR | P42345 | 3/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20215755 | 0.87 | TP53 (0.36) | TP53MAPK1CYP1A2CYP2D6ABCB1 | |
| SCHEMBL17265449 | 0.82 | DRD3 (0.44) | TP53MAPK1CYP1A2CYP2D6HTR1A | |
| SCHEMBL21402686 | 0.79 | TP53 (0.42) | TP53MAPK1CYP1A2CYP2D6ABCB1 | |
| SCHEMBL32667708 | 0.78 | FPR2 (0.42) | TP53MAPK1CYP1A2CYP2D6ABCB1 | |
| SCHEMBL23736096 | 0.76 | TP53 (0.37) | TP53MAPK1CYP1A2CYP2D6ABCB1 | |
| SCHEMBL12905409 | 0.76 | PIM1 (0.57) | TP53CYP1A2CYP2D6HTR1AADRA2A | |
| SCHEMBL17265450 | 0.75 | DRD2 (0.34) | CYP1A2CYP2D6HTR1AADRA2ADRD1 | |
| SCHEMBL23736099 | 0.74 | TP53 (0.35) | TP53MAPK1CYP1A2CYP2D6ABCB1 | |
| SCHEMBL17265448 | 0.73 | DRD3 (0.38) | TP53CYP1A2CYP2D6DRD3LMNA | |
| SCHEMBL17265447 | 0.73 | DRD3 (0.36) | CYP1A2CYP2D6DRD3MAPTMEN1 |
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-9990578-B2 | Redox active polymer devices and methods of using and manufacturing the same | ARIZON BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2018-06-05 | — | — | US | disclosed |