Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A19 | Q695T7 | 1/20 | 0.47 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | C1S | P09871 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.40 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27689903 | 0.81 | GRIK1 (0.40) | ALDH1A1PLAAT5PLAAT4MEN1KMT2A | |
| SCHEMBL6158948 | 0.80 | MAOB (0.49) | MAOBHTT | |
| SCHEMBL6158944 | 0.80 | MAOB (0.49) | MAOBHTT | |
| SCHEMBL15138985 | 0.76 | F10 (0.39) | C1SPLAAT5PLAAT4 | |
| SCHEMBL3111708 | 0.75 | SLC6A19 (0.63) | SLC6A19HSD17B3PKMMAOAMAOB | |
| SCHEMBL3111711 | 0.75 | SLC6A19 (0.63) | SLC6A19HSD17B3PKMMAOAMAOB | |
| SCHEMBL7595301 | 0.73 | HSD17B3 (0.52) | SLC6A19HSD17B3PKMMAOAMAOB | |
| SCHEMBL4084847 | 0.73 | HSD17B3 (0.56) | SLC6A19HSD17B3PKMMAOAMAOB | |
| SCHEMBL12425710 | 0.73 | HSD17B3 (0.52) | SLC6A19HSD17B3PKMMAOAMAOB | |
| SCHEMBL4084843 | 0.73 | HSD17B3 (0.56) | SLC6A19HSD17B3PKMMAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| CN-101111475-A | Antiviral compounds and methods | BIOTRON LTD (AU) | 2008-01-23 | — | — | CN | disclosed |