Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY1 | P47900 | 1/20 | 0.40 |
| ▸ | HINT1 | P49773 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | HBB | P68871 | 1/20 | 0.37 |
| ▸ | NT5E | P21589 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9683196 | 1.00 | P2RY1 (0.40) | P2RY1HINT1KDM4ECYP1A2HBB | |
| SCHEMBL9681390 | 0.82 | HINT1 (0.51) | HINT1NT5E | |
| SCHEMBL15618006 | 0.75 | P2RY1 (0.43) | P2RY1NT5E | |
| SCHEMBL9682463 | 0.75 | HINT1 (0.42) | HINT1 | |
| SCHEMBL9681406 | 0.74 | HINT1 (0.42) | HINT1NT5E | |
| SCHEMBL15618009 | 0.73 | P2RY1 (0.43) | P2RY1NT5E | |
| SCHEMBL23352546 | 0.73 | PNP (0.62) | CYP1A2HBB | |
| SCHEMBL17521211 | 0.73 | PNP (0.62) | CYP1A2HBB | |
| SCHEMBL21162582 | 0.73 | PNP (0.62) | CYP1A2HBB | |
| SCHEMBL29502677 | 0.73 | PNP (0.62) | CYP1A2HBB |
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-5153318-A | Viricides for hepatitis and human t-cell leukemia/lymphoma viruses | BURROUGHS WELLCOME CO. (US) | 1992-10-06 | — | — | US | disclosed |
| EP-0421739-A1 | 3'-azido purine nucleoside | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-04-10 | — | — | EP | disclosed |