Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7395232 | 1.00 | ALDH1A1 (0.32) | ALDH1A1HSD11B1NPSR1BRD4TSHR | |
| SCHEMBL7391162 | 0.85 | BRD4 (0.43) | BRD4 | |
| SCHEMBL7393003 | 0.85 | BRD4 (0.43) | BRD4 | |
| SCHEMBL9031192 | 0.84 | — | — | |
| SCHEMBL9030651 | 0.84 | — | — | |
| SCHEMBL9029811 | 0.84 | — | — | |
| SCHEMBL7390179 | 0.81 | SLC9A1 (0.42) | HSD11B1 | |
| SCHEMBL7392631 | 0.81 | SLC9A1 (0.42) | HSD11B1 | |
| SCHEMBL7391678 | 0.81 | SLC9A1 (0.42) | HSD11B1 | |
| SCHEMBL7392446 | 0.73 | HTR2C (0.36) | — |
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-0646583-A1 | Derivatives of Imidezol-4-yl piperidine, their preparation and use in therapy | SYNTHELABO (FR) | 1995-04-05 | — | — | EP | disclosed |