Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL10769392 | 0.90 | CYP3A4 (0.44) | CYP3A4CYP2C9RECQLPOLBABCB1 | |
| SCHEMBL9756052 | 0.85 | ABCB1 (0.64) | CYP3A4CYP2C9POLBABCB1HTT | |
| SCHEMBL9756128 | 0.85 | CYP3A4 (0.51) | CYP3A4CYP2C9RECQLPOLBABCB1 | |
| SCHEMBL9755889 | 0.83 | CYP3A4 (0.58) | CYP3A4CYP2C9RECQLPOLBABCB1 | |
| SCHEMBL9714308 | 0.83 | CYP3A4 (0.71) | CYP3A4CYP2C9POLBABCB1NPC1 | |
| SCHEMBL9756202 | 0.83 | POLB (0.67) | CYP3A4CYP2C9RECQLPOLBABCB1 | |
| SCHEMBL9756168 | 0.83 | CYP3A4 (0.49) | CYP3A4CYP2C9RECQLPOLBABCB1 | |
| SCHEMBL9755904 | 0.83 | CYP3A4 (0.49) | CYP3A4CYP2C9RECQLPOLBABCB1 | |
| SCHEMBL9714502 | 0.81 | CYP3A4 (0.81) | CYP3A4CYP2C9RECQLPOLBABCB1 | |
| SCHEMBL9756090 | 0.81 | CYP3A4 (0.47) | CYP3A4CYP2C9RECQLPOLBABCB1 |
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-0234944-B1 | INSECTICIDAL N'-SUBSTITUTED-N-ACYL-N'-ALKYLCARBONYLHYDRAZINES | ROHM AND HAAS COMPANY (US) | 1991-04-10 | — | — | EP | disclosed |