Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 5/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.76 |
| ▸ | HPGD | P15428 | 1/20 | 0.74 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.74 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL8772428 | 0.95 | ABCB1 (0.80) | ABCB1CYP3A4HPGDSMN1; SMN2POLB | |
| SCHEMBL9714506 | 0.90 | HPGD (0.78) | ABCB1CYP3A4HPGDSMN1; SMN2POLB | |
| SCHEMBL1045829 | 0.89 | ABCB1 (0.90) | ABCB1CYP3A4HPGDSMN1; SMN2 | |
| SCHEMBL9714197 | 0.89 | ABCB1 (0.82) | ABCB1CYP3A4HPGDSMN1; SMN2POLB | |
| SCHEMBL9824806 | 0.88 | HPGD (0.74) | ABCB1CYP3A4HPGDSMN1; SMN2POLB | |
| SCHEMBL8178344 | 0.87 | ABCB1 (0.84) | ABCB1CYP3A4SMN1; SMN2POLBCYP2C9 | |
| SCHEMBL9714226 | 0.87 | ABCB1 (0.89) | ABCB1CYP3A4POLBCYP2C9 | |
| SCHEMBL9511018 | 0.86 | ABCB1 (0.74) | ABCB1CYP3A4HPGDSMN1; SMN2POLB | |
| Tebufenozide SCHEMBL64845 | 0.86 | ABCB1 (1.00) | ABCB1CYP3A4HPGDSMN1; SMN2 | |
| SCHEMBL10719977 | 0.86 | HPGD (0.89) | ABCB1CYP3A4HPGDSMN1; SMN2POLB |
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-B1 | INSECTICIDAL N'-SUBSTITUTED-N,N'-DIACYLHYDRAZINES | ROHM AND HAAS COMPANY (US) | 1991-02-27 | — | — | EP | disclosed |