Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | C5AR1 | P21730 | 2/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9136952 | 1.00 | POLB (0.43) | POLBATMHTR3ADRD2ALDH1A1 | |
| SCHEMBL13832594 | 0.90 | POLB (0.44) | POLBATMHTR3ADRD2ALDH1A1 | |
| SCHEMBL18251916 | 0.84 | L3MBTL1 (0.39) | ATMALDH1A1CYP3A4CYP2C19NPSR1 | |
| SCHEMBL19339361 | 0.84 | ESR2 (0.49) | CYP2C9CYP3A4CYP2D6 | |
| SCHEMBL8517243 | 0.83 | ESR2 (0.40) | POLBHTR3ADRD2ALDH1A1GAA | |
| SCHEMBL8517245 | 0.83 | ESR2 (0.40) | POLBHTR3ADRD2ALDH1A1GAA | |
| SCHEMBL14403053 | 0.80 | ESR2 (0.42) | POLBSLC6A3 | |
| SCHEMBL7780450 | 0.80 | NPC1 (0.37) | POLBALDH1A1MAPTTSHR | |
| SCHEMBL9481353 | 0.80 | NPC1 (0.37) | POLBALDH1A1MAPTTSHR | |
| SCHEMBL10043067 | 0.80 | PDE10A (0.36) | ALDH1A1C5AR1NPSR1MAPT |
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-5174921-A | BICYCLOHEXYL DERIVATIVES | HOFFMANN-LA ROCHE INC. (US) | 1992-12-29 | — | — | US | disclosed |