Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 3/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL1862498 | 0.98 | GPR3 (0.37) | GPR3ALDH1A1CYP1A2CYP3A4ALOX15 | |
| SCHEMBL5260413 | 0.77 | MAPT (0.45) | GPR3ALDH1A1CYP1A2CYP3A4ALOX15 | |
| Bromide SCHEMBL1863432 | 0.75 | MAPT (0.44) | GPR3ALDH1A1CYP1A2CYP3A4ALOX15 | |
| SCHEMBL12629620 | 0.73 | GPR3 (0.40) | GPR3ALDH1A1CYP1A2CYP3A4ALOX15 | |
| SCHEMBL1857808 | 0.73 | GPR3 (0.40) | GPR3ALDH1A1CYP1A2CYP3A4ALOX15 | |
| Bromide SCHEMBL1862922 | 0.72 | GPR3 (0.39) | GPR3ALDH1A1CYP1A2CYP3A4ALOX15 | |
| SCHEMBL5262165 | 0.71 | TP53 (0.43) | ALDH1A1CYP1A2CYP3A4ALOX15HIF1A | |
| SCHEMBL5258551 | 0.71 | GPR3 (0.38) | GPR3ALDH1A1CYP1A2CYP3A4ALOX15 | |
| Bromide SCHEMBL15201212 | 0.71 | MAPT (0.36) | GPR3ALDH1A1CYP1A2CYP3A4ALOX15 | |
| SCHEMBL5258416 | 0.71 | GPR3 (0.41) | GPR3ALDH1A1CYP1A2CYP3A4ALOX15 |
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-1692130-B1 | PHENANTHRIDINIUM DERIVATIVES AS DNA BINDING AGENTS | UNIV GLASGOW (GB) | 2007-08-08 | — | — | EP | claimed |