Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | TK1 | P04183 | 1/20 | 0.68 |
| ▸ | BLM | P54132 | 1/20 | 0.68 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.68 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.68 |
| ▸ | TYMS | P04818 | 3/20 | 0.54 |
| ▸ | TK2 | O00142 | 3/20 | 0.52 |
| ▸ | RNASE1 | P07998 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11204603 | 1.00 | CYP1A2 (0.68) | CYP1A2CYP3A4TSHRTK1BLM | |
| SCHEMBL11204606 | 1.00 | CYP1A2 (0.68) | CYP1A2CYP3A4TSHRTK1BLM | |
| SCHEMBL11203211 | 0.92 | CYP1A2 (0.65) | CYP1A2CYP3A4TSHRTK1BLM | |
| SCHEMBL3077419 | 0.92 | TK1 (0.65) | CYP1A2CYP3A4TSHRTK1BLM | |
| SCHEMBL11200828 | 0.92 | TK1 (0.65) | CYP1A2CYP3A4TSHRTK1BLM | |
| SCHEMBL11203217 | 0.92 | CYP1A2 (0.65) | CYP1A2CYP3A4TSHRTK1BLM | |
| SCHEMBL11203214 | 0.92 | CYP1A2 (0.65) | CYP1A2CYP3A4TSHRTK1BLM | |
| SCHEMBL3077417 | 0.92 | TK1 (0.65) | CYP1A2CYP3A4TSHRTK1BLM | |
| SCHEMBL3085098 | 0.92 | TK1 (0.58) | CYP1A2CYP3A4TSHRTK1BLM | |
| SCHEMBL3085099 | 0.92 | TK1 (0.58) | CYP1A2CYP3A4TSHRTK1BLM |
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-0082668-A1 | 5-(2-Halogenovinyl)-2'-deoxyuridine derivatives, processes for their preparation, pharmaceutical compositions containing them and their use in treating viral infections | BEECHAM GROUP PLC (GB) | 1983-06-29 | — | — | EP | disclosed |