Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL1131039 | 0.78 | SLC6A2 (0.54) | MAPTNPSR1ATMSLC6A2SLC6A4 | |
| Methane SCHEMBL28543758 | 0.76 | SLC6A2 (0.52) | MAPTNPSR1ATMSLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL6775513 | 0.76 | SLC6A2 (0.52) | MAPTNPSR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3296607 | 0.76 | ALOX5 (0.42) | MAPTALDH1A1NPSR1PKMHPGD | |
| SCHEMBL9867532 | 0.76 | AHR (0.49) | AHRMAPTALDH1A1NPSR1PKM | |
| SCHEMBL9866058 | 0.75 | AHR (0.51) | AHRMAPTALDH1A1NPSR1PKM | |
| SCHEMBL3452399 | 0.75 | MAPT (0.39) | AHRMAPTALDH1A1NPSR1PKM | |
| Iodide SCHEMBL28780518 | 0.74 | ALOX5 (0.41) | AHRMAPTALDH1A1NPSR1PKM | |
| SCHEMBL589267 | 0.72 | SLC6A3 (0.54) | AHRMAPTALDH1A1NPSR1SLC6A2 | |
| SCHEMBL17842115 | 0.72 | SLC6A2 (0.48) | AHRMAPTNPSR1SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005023794-A2 | COMPOUND LIBRARIES OF 4-CARBOXAMIDOPIPERIDINE DERIVATIVES | BIOFOCUS PLC (GB) | 2005-03-17 | — | — | WO | disclosed |