Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | GRM5 | P41594 | 3/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9756227 | 0.98 | CYP3A4 (0.50) | CYP3A4CYP2C9GRM5RECQLPOLB | |
| SCHEMBL9756164 | 0.96 | CYP3A4 (0.49) | CYP3A4CYP2C9GRM5RECQLPOLB | |
| SCHEMBL9755902 | 0.96 | CYP3A4 (0.49) | CYP3A4CYP2C9GRM5RECQLPOLB | |
| SCHEMBL9756334 | 0.96 | CYP3A4 (0.49) | CYP3A4CYP2C9GRM5RECQLPOLB | |
| SCHEMBL9756147 | 0.95 | CYP3A4 (0.56) | CYP3A4CYP2C9RECQLPOLBABCB1 | |
| SCHEMBL9756247 | 0.86 | ABCB1 (0.60) | CYP3A4CYP2C9POLBABCB1EPHX2 | |
| SCHEMBL9755963 | 0.84 | POLB (0.61) | CYP3A4CYP2C9RECQLPOLB | |
| SCHEMBL9755937 | 0.84 | ABCB1 (0.60) | CYP3A4CYP2C9POLBABCB1EPHX2 | |
| SCHEMBL9756191 | 0.83 | ABCB1 (0.58) | CYP3A4CYP2C9POLBABCB1EPHX2 | |
| SCHEMBL9755881 | 0.83 | ABCB1 (0.58) | CYP3A4CYP2C9POLBABCB1EPHX2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0234944-B1 | INSECTICIDAL N'-SUBSTITUTED-N-ACYL-N'-ALKYLCARBONYLHYDRAZINES | ROHM AND HAAS COMPANY (US) | 1991-04-10 | — | — | EP | disclosed |
| EP-0232075-B1 | INSECTICIDAL N'-SUBSTITUTED-N-ALKYLCARBONYL-N'-ACYL HYDRAZINES | ROHM AND HAAS COMPANY (US) | 1991-03-13 | — | — | EP | disclosed |
| EP-0232075-A1 | Insecticidal N'-substituted-N-alkylcarbonyl-N'-acyl hydrazines | ROHM AND HAAS COMPANY (US) | 1987-08-12 | — | — | EP | disclosed |