Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.50 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.50 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.41 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.41 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11877009 | 0.89 | CASP3 (0.45) | ALDH1A1CES1CHRM1ALDH3A1ALDH2 | |
| SCHEMBL11877884 | 0.79 | ALDH1A1 (0.49) | ALDH1A1CES1CHRM1ALDH3A1ALDH2 | |
| SCHEMBL11872380 | 0.76 | TSHR (0.51) | ALDH1A1CES1CHRM1ALDH3A1ALDH2 | |
| SCHEMBL11874431 | 0.75 | DRD2 (0.40) | ALDH1A1TSHRNPSR1L3MBTL1 | |
| SCHEMBL11879082 | 0.70 | TSHR (0.47) | ALDH1A1CES1CHRM1ALDH3A1TSHR | |
| SCHEMBL2493279 | 0.68 | TSHR (0.83) | ALDH1A1CES1CHRM1ALDH3A1ALDH2 | |
| SCHEMBL11850946 | 0.68 | TSHR (0.70) | ALDH1A1CES1CHRM1ALDH3A1ALDH2 | |
| SCHEMBL29506660 | 0.68 | ALDH1A1 (1.00) | ALDH1A1CES1CHRM1ALDH3A1ALDH2 | |
| SCHEMBL2087729 | 0.68 | ALDH1A1 (1.00) | ALDH1A1CES1CHRM1ALDH3A1ALDH2 | |
| SCHEMBL11878613 | 0.68 | TSHR (0.50) | ALDH1A1CES1CHRM1ALDH3A1TSHR |
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-3982000-A | Alkyl-substituted-tricyclic quinazolinones as bronchodilators | SANDOZ, INC. (US) | 1976-09-21 | — | — | US | claimed |