Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.47 |
| ▸ | GABRP | O00591 | 1/20 | 0.43 |
| ▸ | GABRD | O14764 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.43 |
| ▸ | GABRE | P78334 | 1/20 | 0.43 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11078643 | 0.92 | ALDH1A1 (0.49) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL4020068 | 0.82 | ALDH1A1 (0.47) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL11007812 | 0.82 | GABRP (0.52) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL10805714 | 0.79 | ALDH1A1 (0.47) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL27513043 | 0.77 | GABRP (0.55) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL10998695 | 0.76 | TDP1 (0.55) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL13316485 | 0.76 | CYP3A4 (0.54) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL22769279 | 0.73 | ALDH1A1 (0.45) | ALDH1A1HTTMAPTLMNASMN1; SMN2 | |
| SCHEMBL10333705 | 0.73 | ALDH1A1 (0.48) | ALDH1A1HTTNPSR1MITFHSP90AA1 | |
| SCHEMBL11037117 | 0.72 | MAPT (0.50) | ALDH1A1HTTNPSR1MITFHSP90AA1 |
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-4428879-A | SEDATIVES, TRANQUILIZERS | HOFFMANN-LA ROCHE INC. (US) | 1984-01-31 | — | — | US | disclosed |