Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHPS | P49366 | 15/20 | 0.62 |
| ▸ | EDNRA | P25101 | 6/20 | 0.50 |
| ▸ | EDNRB | P24530 | 4/20 | 0.49 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.45 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.45 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4066782 | 0.87 | DHPS (0.66) | DHPSEDNRAEDNRB | |
| SCHEMBL4061140 | 0.84 | EDNRA (0.67) | DHPSEDNRAEDNRBABCC3ABCC4 | |
| SCHEMBL6585958 | 0.83 | DHPS (0.55) | DHPS | |
| SCHEMBL7853937 | 0.80 | DHPS (0.57) | DHPSEDNRAEDNRBABCC3ABCC4 | |
| SCHEMBL6961199 | 0.80 | EDNRA (0.76) | DHPSEDNRAEDNRBABCC3ABCC4 | |
| SCHEMBL4060942 | 0.79 | DHPS (0.56) | DHPSEDNRAEDNRB | |
| SCHEMBL6961425 | 0.79 | EDNRA (0.71) | DHPSEDNRAEDNRBABCC3ABCC4 | |
| SCHEMBL6960620 | 0.79 | EDNRA (0.69) | DHPSEDNRAEDNRBABCC3ABCC4 | |
| SCHEMBL6970783 | 0.79 | EDNRA (0.71) | DHPSEDNRAEDNRBABCC3ABCC4 | |
| SCHEMBL6584032 | 0.78 | DHPS (0.55) | DHPSEDNRAEDNRBABCC3ABCC4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0897914-B1 | Process for the preparation of 2,5-disubstitued pyridines | HOFFMANN LA ROCHE (CH) | 2004-05-26 | — | — | EP | claimed |