Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.36 |
| ▸ | BACE1 | P56817 | 2/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL6510422 | 0.83 | BACE1 (0.36) | BACE1PTPN1PTPN6PTPN11ALOX5AP | |
| SCHEMBL29588993 | 0.79 | CYP3A4 (0.44) | ESR2ALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL30607044 | 0.78 | ESR2 (0.38) | ARESR2TRPA1APP | |
| SCHEMBL29051242 | 0.78 | ESR2 (0.38) | ARESR2TRPA1APP | |
| SCHEMBL19590795 | 0.77 | ALOX5AP (0.39) | BACE1ALOX5APFEN1KLKB1 | |
| SCHEMBL28818238 | 0.76 | ALDH1A1 (0.45) | PTPN1PTPN6PTPN11ALDH1A1HSD17B10 | |
| SCHEMBL29159006 | 0.76 | CYP2A6 (0.46) | BACE1ESR2ALDH1A1HSD17B10HPGD | |
| SCHEMBL6757877 | 0.74 | CYP2A6 (0.44) | BACE1ESR2ALDH1A1HSD17B10L3MBTL1 | |
| SCHEMBL1302811 | 0.73 | CYP2A6 (0.48) | BACE1ESR2ALDH1A1HSD17B10HPGD | |
| SCHEMBL6509956 | 0.73 | MEN1 (0.39) | PTPN1PTPN6PTPN11ALDH1A1HSD17B10 |
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-20050101063-A1 | Three-terminal field-controlled molecular devices | TOUR JAMES M (US) | 2005-05-12 | — | — | US | disclosed |
| WO-2002035580-A2 | THREE-TERMINAL FIELD-CONTROLLED MOLECULAR DEVICES | MOLECULAR ELECTRONICS CORPORATION (US) | 2002-05-02 | — | — | WO | disclosed |