Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 8/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | GRM5 | P41594 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10719534 | 0.91 | ABCB1 (0.67) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL9714256 | 0.89 | POLB (0.68) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL9714261 | 0.89 | CYP3A4 (0.75) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL9714226 | 0.89 | ABCB1 (0.89) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL10721518 | 0.83 | ABCB1 (1.00) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL8178344 | 0.83 | ABCB1 (0.84) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL9507281 | 0.83 | CYP3A4 (0.83) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL10722074 | 0.83 | ABCB1 (0.89) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL8166728 | 0.83 | ABCB1 (0.78) | ABCB1CYP3A4CYP2C9POLB | |
| SCHEMBL9714197 | 0.82 | ABCB1 (0.82) | ABCB1CYP3A4CYP2C9POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-6013836-A | PARTICULARLY ACTIVE AGAINST MOTHS AND BEETLES AND THEIR INSECT GROWTH REGULATING ACTIVITY WITHOUT ADVERSE IMPACT ON BENEFICIAL INSECTS; CROPS; FORESTRY | ROHM AND HAAS COMPANY (US) | 2000-01-11 | — | — | US | disclosed |
| EP-0236618-A2 | Insecticidal N'-substituted-N,N'-diacylhydrazines | ROHM AND HAAS COMPANY (US) | 1987-09-16 | — | — | EP | disclosed |