Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PI4K2A | Q9BTU6 | 5/20 | 0.43 |
| ▸ | PI4KA | P42356 | 4/20 | 0.43 |
| ▸ | PI4K2B | Q8TCG2 | 4/20 | 0.43 |
| ▸ | PI4KB | Q9UBF8 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9548804 | 0.88 | HINT1 (0.40) | ADORA2ASMN1; SMN2TP53ADORA3ADORA1 | |
| SCHEMBL9548808 | 0.84 | ADA (0.51) | ADORA2ANFKB1BLMPI4K2API4KA | |
| SCHEMBL9548702 | 0.82 | HINT1 (0.43) | ADORA3 | |
| SCHEMBL9548593 | 0.81 | AHCY (0.44) | PRMT5WDR77ADORA3ADAHSP90B1 | |
| SCHEMBL9548589 | 0.81 | AHCY (0.44) | PRMT5WDR77ADORA3ADAHSP90B1 | |
| SCHEMBL9548665 | 0.76 | HSP90B1 (0.38) | ADAHSP90B1ADCY5AHCY | |
| SCHEMBL9548672 | 0.76 | HSP90B1 (0.38) | ADAHSP90B1ADCY5AHCY | |
| SCHEMBL9548867 | 0.74 | PDE3A (0.41) | — | |
| SCHEMBL6243153 | 0.73 | BCHE (0.55) | ADORA2ANFKB1BLMCYP1A2CYP3A4 | |
| SCHEMBL21427226 | 0.73 | BCHE (0.55) | ADORA2ANFKB1BLMCYP1A2CYP3A4 |
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-5192749-A | Viricide, AIDS | SYNTEX (U.S.A.) INC. (US) | 1993-03-09 | — | — | US | disclosed |