Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 13/20 | 0.58 |
| ▸ | CYP1B1 | Q16678 | 13/20 | 0.58 |
| ▸ | MAOB | P27338 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | P4HB | P07237 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | CXCL12 | P48061 | 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 | |
|---|---|---|---|---|
| SCHEMBL24951715 | 0.83 | ALDH1A1 (0.59) | MAOBMAPTNPSR1 | |
| SCHEMBL28630576 | 0.83 | ALDH1A1 (0.59) | MAOBMAPTNPSR1 | |
| SCHEMBL29098727 | 0.83 | MAOB (0.55) | MAOBMAPTNPSR1 | |
| SCHEMBL14601551 | 0.82 | ALDH1A1 (0.68) | CYP1B1MAOBMAPTNPSR1 | |
| SCHEMBL28789132 | 0.82 | ALDH1A1 (0.68) | CYP1B1MAOBMAPTNPSR1 | |
| SCHEMBL10920916 | 0.81 | CA12 (0.63) | MAOBMAPTP4HBNPSR1 | |
| SCHEMBL10920915 | 0.81 | CA12 (0.63) | MAOBMAPTP4HBNPSR1 | |
| SCHEMBL1689727 | 0.80 | CA12 (0.67) | CYP1A1CYP1B1MAOB | |
| SCHEMBL1689725 | 0.80 | CA12 (0.67) | CYP1A1CYP1B1MAOB | |
| SCHEMBL3939718 | 0.80 | NPSR1 (0.49) | CYP1A1CYP1B1MAOBMAPTNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116554056-A | Cyclohexane compound with multiple functional groups and preparation method thereof | 贵州医科大学 | 2023-08-08 | — | — | CN | disclosed |