Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 2/20 | 0.52 |
| ▸ | DNM1 | Q05193 | 6/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | MLNR | O43193 | 1/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15538817 | 1.00 | SLC22A1 (0.52) | SLC22A1DNM1TP53SMN1; SMN2ALDH1A1 | |
| SCHEMBL15538699 | 1.00 | SLC22A1 (0.52) | SLC22A1DNM1TP53SMN1; SMN2ALDH1A1 | |
| Tetrahexylammonium SCHEMBL3051566 | 1.00 | SLC22A1 (0.52) | SLC22A1DNM1TP53SMN1; SMN2ALDH1A1 | |
| SCHEMBL8571872 | 1.00 | SLC22A1 (0.52) | SLC22A1DNM1TP53SMN1; SMN2ALDH1A1 | |
| SCHEMBL1520532 | 1.00 | SLC22A1 (0.52) | SLC22A1DNM1TP53SMN1; SMN2ALDH1A1 | |
| Tetrapentylammonium SCHEMBL8610604 | 0.98 | SLC22A1 (0.50) | SLC22A1DNM1TP53SMN1; SMN2ALDH1A1 | |
| Tetrabuthylammonium SCHEMBL14916 | 0.94 | SLC22A1 (0.50) | SLC22A1DNM1TP53SMN1; SMN2ALDH1A1 | |
| Tetrabuthylammonium SCHEMBL10643545 | 0.90 | SLC22A1 (0.46) | SLC22A1DNM1TP53SMN1; SMN2ALDH1A1 | |
| Octane SCHEMBL18395350 | 0.89 | DNM1 (0.44) | DNM1TP53SMN1; SMN2TSHRMEN1 | |
| SCHEMBL4351872 | 0.89 | DNM1 (0.56) | DNM1TP53SMN1; SMN2ALDH1A1CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8765060-B2 | Chemical sensor | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2014-07-01 | — | — | US | disclosed |
| US-20080293997-A1 | Chemical Sensor | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2008-11-27 | — | — | US | disclosed |
| EP-1888330-A2 | CHEMICAL SENSOR | The Regents of the University of Minnesota (US) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006127963-A2 | CHEMICAL SENSOR | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2006-11-30 | — | — | WO | disclosed |