Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 6/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9425631 | 0.96 | ABCB1 (0.48) | ABCB1CYP3A4CYP2C9POLBHPGD | |
| SCHEMBL9714538 | 0.84 | POLB (0.63) | ABCB1CYP3A4CYP2C9POLBHPGD | |
| SCHEMBL8166763 | 0.80 | POLB (0.74) | ABCB1CYP3A4CYP2C9POLBHPGD | |
| SCHEMBL9652010 | 0.80 | POLB (0.74) | ABCB1CYP3A4CYP2C9POLBHPGD | |
| SCHEMBL9495409 | 0.76 | ABCB1 (0.60) | ABCB1CYP3A4CYP2C9POLBHPGD | |
| SCHEMBL9714310 | 0.74 | POLB (0.68) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL25381850 | 0.73 | CYP11B1 (0.64) | POLBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL30354874 | 0.73 | CYP11B1 (0.64) | POLBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL9714603 | 0.73 | CYP3A4 (0.73) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL5057049 | 0.73 | ABCB1 (0.78) | ABCB1CYP3A4CYP2C9POLBHPGD |
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 |