Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 10/20 | 0.60 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.56 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.52 |
| ▸ | PI4KA | P42356 | 1/20 | 0.52 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.52 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.52 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.50 |
| ▸ | FAP | Q12884 | 1/20 | 0.49 |
| ▸ | AHCY | P23526 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL15045890 | 0.86 | CYP3A4 (0.70) | CYP3A4ADORA2AADORA1CYP2D6PI4KA | |
| SCHEMBL16229939 | 0.86 | CYP3A4 (0.60) | CYP3A4ADORA2AADORA1CYP2D6PI4KA | |
| SCHEMBL18543643 | 0.86 | CYP3A4 (0.63) | CYP3A4ADORA2AADORA1CYP2D6PI4KA | |
| SCHEMBL18543642 | 0.86 | CYP3A4 (0.63) | CYP3A4ADORA2AADORA1CYP2D6PI4KA | |
| SCHEMBL21359605 | 0.84 | CYP3A4 (0.67) | CYP3A4ADORA2AADORA1CYP2D6PI4KA | |
| SCHEMBL20041166 | 0.84 | CYP3A4 (0.67) | CYP3A4ADORA2AADORA1CYP2D6PI4KA | |
| SCHEMBL16229935 | 0.84 | CYP3A4 (0.58) | CYP3A4ADORA2AADORA1CYP2D6PI4KA | |
| SCHEMBL28962216 | 0.82 | CYP3A4 (0.61) | CYP3A4ADORA2AADORA1CYP2D6PI4KA | |
| SCHEMBL19831469 | 0.82 | FAP (0.70) | CYP3A4ADORA2AADORA1CYP2D6FAP | |
| SCHEMBL15257613 | 0.80 | CYP3A4 (0.68) | CYP3A4ADORA2AADORA1CYP2D6PI4KA |
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-105622671-A | Preparing method for realizing industrial mass production of tenofovir disoproxil fumarate | GUANGDONG KINGHO PHARMACEUTICAL RANDD CO LTD | 2016-06-01 | — | — | CN | disclosed |