Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TK1 | P04183 | 3/20 | 0.70 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.70 |
| ▸ | TSHR | P16473 | 1/20 | 0.70 |
| ▸ | BLM | P54132 | 1/20 | 0.70 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.70 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.70 |
| ▸ | RNASE1 | P07998 | 1/20 | 0.57 |
| ▸ | TK2 | O00142 | 8/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL11288942 | 1.00 | TK1 (0.70) | TK1CYP1A2CYP3A4TSHRBLM | |
| SCHEMBL11288944 | 1.00 | TK1 (0.70) | TK1CYP1A2CYP3A4TSHRBLM | |
| SCHEMBL3078493 | 0.92 | TK1 (0.61) | TK1CYP1A2CYP3A4TSHRBLM | |
| SCHEMBL3078490 | 0.92 | TK1 (0.61) | TK1CYP1A2CYP3A4TSHRBLM | |
| SCHEMBL3083997 | 0.90 | TK1 (0.58) | TK1CYP1A2CYP3A4TSHRBLM | |
| SCHEMBL3078240 | 0.89 | TK1 (0.74) | TK1CYP1A2CYP3A4TSHRBLM | |
| SCHEMBL3078242 | 0.89 | TK1 (0.74) | TK1CYP1A2CYP3A4TSHRBLM | |
| SCHEMBL3072363 | 0.89 | TK1 (0.57) | TK1CYP1A2CYP3A4TSHRBLM | |
| SCHEMBL3072364 | 0.89 | TK1 (0.57) | TK1CYP1A2CYP3A4TSHRBLM | |
| SCHEMBL11199188 | 0.89 | TK1 (0.67) | TK1CYP1A2CYP3A4TSHRBLM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0061283-A1 | Antiviral agents, their preparation and use | BEECHAM GROUP PLC (GB) | 1982-09-29 | — | — | EP | claimed |
| EP-0060099-A1 | Antiviral agents, their preparation and use | BEECHAM GROUP PLC (GB) | 1982-09-15 | — | — | EP | disclosed |