Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL28366278 | 0.77 | CYP1A2 (0.51) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL324644 | 0.75 | SLC6A3 (0.39) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL17029101 | 0.75 | SMN1; SMN2 (0.45) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11932194 | 0.72 | — | — | |
| SCHEMBL4685254 | 0.68 | MEN1 (0.37) | CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28332895 | 0.66 | — | — | |
| SCHEMBL27810521 | 0.65 | BTK (0.36) | BTK | |
| SCHEMBL18857506 | 0.64 | CCNE1 (0.39) | — | |
| SCHEMBL28118092 | 0.63 | ALDH1A1 (0.35) | — | |
| SCHEMBL4974945 | 0.63 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105745214-B | Tricyclic piperidine compounds | 埃科特莱茵药品有限公司 | 2019-02-19 | — | — | CN | disclosed |
| CN-105745214-A | Tricyclic piperidine compounds | 埃科特莱茵药品有限公司 | 2016-07-06 | — | — | CN | disclosed |