Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | MYC | P01106 | 1/20 | 0.35 |
| ▸ | WDR5 | P61964 | 1/20 | 0.35 |
| ▸ | POLA1 | P09884 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6668075 | 0.92 | ABCB1 (0.38) | ABCB1MAPTTHRBALDH1A1POLB | |
| SCHEMBL7080399 | 0.88 | ABCB1 (0.37) | ABCB1MAPTTHRBALDH1A1POLB | |
| SCHEMBL6694399 | 0.82 | MAPT (0.41) | ABCB1MAPTTHRBALDH1A1POLB | |
| SCHEMBL6694017 | 0.79 | POLA1 (0.40) | MAPTTHRBALDH1A1POLA1KCNH2 | |
| SCHEMBL6695578 | 0.77 | ABCB1 (0.40) | ABCB1MAPTTHRBALDH1A1POLB | |
| SCHEMBL6694556 | 0.77 | POLA1 (0.41) | MAPTTHRBPOLA1KCNH2 | |
| SCHEMBL6669520 | 0.77 | ABCB1 (0.39) | ABCB1MAPTTHRBALDH1A1POLB | |
| SCHEMBL6670559 | 0.77 | POLA1 (0.42) | MAPTTHRBPOLA1KCNH2 | |
| SCHEMBL7086767 | 0.76 | POLA1 (0.38) | ABCB1MAPTTHRBPOLA1 | |
| SCHEMBL6691109 | 0.75 | POLA1 (0.53) | ABCB1ALDH1A1POLA1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6624160-B2 | Especially infections of herpes simplex virus type 1, 2, 6, 7, or 8, varicella zoster virus, human cytomegalovirus or epstein-Barr virus; enzyme inhibitors of virus DNA polymerase | PHARMACIA & UPJOHN CO. | 2003-09-23 | — | — | US | disclosed |