Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.50 |
| ▸ | DPP4 | P27487 | 1/20 | 0.47 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.42 |
| ▸ | NLN | Q9BYT8 | 3/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2586204 | 1.00 | CYP3A4 (0.50) | CYP3A4SLC7A5DPP4DPP7NLN | |
| SCHEMBL1537285 | 0.80 | CYP3A4 (0.71) | CYP3A4SLC7A5 | |
| SCHEMBL163444 | 0.80 | CYP3A4 (0.71) | CYP3A4SLC7A5 | |
| SCHEMBL27273945 | 0.80 | CYP3A4 (0.50) | CYP3A4SLC7A5DPP4NLN | |
| Hydrochloric Acid SCHEMBL28331180 | 0.79 | CYP3A4 (0.69) | CYP3A4SLC7A5 | |
| SCHEMBL28328192 | 0.77 | CYP3A4 (0.67) | CYP3A4SLC7A5 | |
| SCHEMBL3726266 | 0.76 | CTSC (0.50) | CYP3A4SLC7A5DPP4DPP7 | |
| SCHEMBL2478803 | 0.76 | CTSC (0.50) | CYP3A4SLC7A5DPP4DPP7 | |
| SCHEMBL498386 | 0.76 | CTSC (0.50) | CYP3A4SLC7A5DPP4DPP7 | |
| SCHEMBL5221763 | 0.76 | CYP3A4 (0.65) | CYP3A4SLC7A5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4127517-A | ANALGESIC | VETERANS ADMINISTRATION, THE UNITED STATES OF AMERICA AS REPRESENTED BY | 1978-11-28 | — | — | US | claimed |
| US-4127520-A | ANALGESIC | VETERANS ADMINISTRATION, THE UNITED STATES OF AMERICA AS REPRESENTED BY | 1978-11-28 | — | — | US | claimed |