Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9425422 | 0.89 | POLB (0.55) | POLBCYP3A4CYP2C9HPGDSMN1; SMN2 | |
| SCHEMBL9425311 | 0.88 | POLB (0.50) | POLBCYP3A4CYP2C9HPGDSMN1; SMN2 | |
| SCHEMBL9426130 | 0.87 | POLB (0.72) | POLBCYP3A4CYP2C9 | |
| SCHEMBL9426098 | 0.84 | HPGD (0.73) | POLBCYP3A4CYP2C9HPGDSMN1; SMN2 | |
| SCHEMBL9714227 | 0.84 | POLB (0.71) | POLBCYP3A4CYP2C9HPGDSMN1; SMN2 | |
| SCHEMBL9815764 | 0.83 | ABCB1 (0.51) | — | |
| SCHEMBL4150390 | 0.82 | POLB (0.82) | POLBCYP3A4CYP2C9HPGDSMN1; SMN2 | |
| Halofenozide SCHEMBL55120 | 0.82 | POLB (0.82) | POLBCYP3A4CYP2C9HPGDSMN1; SMN2 | |
| Halofenozide SCHEMBL28789879 | 0.81 | POLB (0.70) | POLBCYP3A4CYP2C9HPGDSMN1; SMN2 | |
| SCHEMBL9815878 | 0.79 | ABCB1 (0.72) | POLBCYP3A4CYP2C9 |
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-0253468-B1 | SIX-MEMBERED HETEROCYCLIC DERIVATIVES OF N'SUBSTITUTED-N,N'-DIACYLHYDRAZINES | ROHM AND HAAS COMPANY (US) | 1991-11-06 | — | — | EP | disclosed |