Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 2/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29208265 | 0.83 | HRH3 (0.42) | MGLLFAAH | |
| SCHEMBL17274451 | 0.67 | ALDH1A1 (0.37) | MGLLFAAHAKR1C3 | |
| SCHEMBL1010938 | 0.62 | LTA4H (0.33) | MGLLFAAHAKR1C3 | |
| SCHEMBL13178304 | 0.60 | HRH3 (0.61) | — | |
| SCHEMBL578597 | 0.60 | HTR2A (0.34) | — | |
| SCHEMBL25306664 | 0.60 | SMN1; SMN2 (0.44) | — | |
| SCHEMBL28414579 | 0.59 | — | — | |
| SCHEMBL13178476 | 0.59 | HRH3 (0.48) | — | |
| SCHEMBL14345952 | 0.58 | AKR1C3 (0.57) | MGLLFAAHAKR1C3 | |
| SCHEMBL16144142 | 0.57 | LTA4H (0.46) | MGLLFAAHAKR1C3 |
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-117720456-A | New method for synthesizing apixaban intermediate 3, 3-dichloro-1- (4-substituted phenyl) piperidine-2-ketone | 华东理工大学 | 2024-03-19 | — | — | CN | disclosed |