Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 7/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL10719275 | 0.90 | ABCB1 (0.53) | ABCB1CYP3A4CYP2C9CYP2C19HTT | |
| SCHEMBL10721235 | 0.90 | ABCB1 (0.60) | ABCB1CYP3A4CYP2C9 | |
| SCHEMBL10721753 | 0.88 | ABCB1 (0.71) | ABCB1CYP3A4CYP2C9CYP2C19HTT | |
| SCHEMBL10721508 | 0.84 | ABCB1 (0.77) | ABCB1CYP3A4CYP2C9 | |
| SCHEMBL668612 | 0.84 | ABCB1 (0.71) | ABCB1CYP3A4 | |
| SCHEMBL16077540 | 0.84 | ABCB1 (0.59) | ABCB1CYP3A4CYP2C9CYP2C19HTT | |
| SCHEMBL10721812 | 0.82 | ABCB1 (0.72) | ABCB1CYP3A4CYP2C9CYP2C19HTT | |
| SCHEMBL10721974 | 0.80 | ABCB1 (0.70) | ABCB1CYP3A4CYP2C9 | |
| SCHEMBL10718698 | 0.79 | ABCB1 (0.61) | ABCB1 | |
| SCHEMBL17624858 | 0.79 | ABCB1 (0.77) | ABCB1 |
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-0236618-A2 | Insecticidal N'-substituted-N,N'-diacylhydrazines | ROHM AND HAAS COMPANY (US) | 1987-09-16 | — | — | EP | disclosed |