Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX1 | P51575 | 1/20 | 0.63 |
| ▸ | GRM4 | Q14833 | 4/20 | 0.62 |
| ▸ | HTT | P42858 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.57 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | ABL1 | P00519 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2532524 | 0.88 | GRM4 (0.74) | P2RX1GRM4HTTMAPTALDH1A1 | |
| SCHEMBL17448399 | 0.85 | SMN1; SMN2 (0.71) | HTTMAPTGAATSHRNPC1 | |
| SCHEMBL5498009 | 0.81 | RAB9A (0.71) | P2RX1HTTMAPTALDH1A1GAA | |
| SCHEMBL2095973 | 0.80 | ALDH1A1 (0.60) | P2RX1HTTMAPTALDH1A1GAA | |
| SCHEMBL12480670 | 0.80 | L3MBTL1 (0.61) | P2RX1HTTMAPTALDH1A1GAA | |
| SCHEMBL2095975 | 0.80 | ALDH1A1 (0.60) | P2RX1HTTMAPTALDH1A1GAA | |
| SCHEMBL14971103 | 0.80 | ALDH1A1 (0.58) | P2RX1GRM4HTTMAPTALDH1A1 | |
| SCHEMBL14965562 | 0.80 | ALDH1A1 (0.58) | P2RX1GRM4HTTMAPTALDH1A1 | |
| SCHEMBL29556351 | 0.80 | P2RX1 (0.56) | P2RX1HTTMAPTALDH1A1GAA | |
| SCHEMBL12368157 | 0.80 | NPC1 (0.65) | P2RX1HTTMAPTALDH1A1GAA |
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-20160018344-A1 | SENSOR AND METHOD OF DETECTING AN ANALYTE USING 19F NMR | MASSACHUSETTS INSTITUTE OF TECHNOLOGY | 2016-01-21 | — | — | US | disclosed |