Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 5/20 | 0.31 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL27468419 | 0.78 | SLC6A4 (0.32) | CNR2 | |
| SCHEMBL27466038 | 0.78 | SIGMAR1 (0.35) | ALDH1A1GLACYP2C19CNR2 | |
| SCHEMBL8327501 | 0.76 | SIGMAR1 (0.39) | CNR2 | |
| Hydrochloric Acid SCHEMBL7314180 | 0.75 | SIGMAR1 (0.38) | CNR2 | |
| SCHEMBL27502462 | 0.72 | CYP2C19 (0.40) | CYP2C19CNR2 | |
| SCHEMBL8329039 | 0.70 | ALDH1A1 (0.35) | ALDH1A1GLACYP2C19 | |
| SCHEMBL8652251 | 0.66 | ALDH1A1 (0.38) | ALDH1A1GLACYP2C19CNR2 | |
| Hydrochloric Acid SCHEMBL7324538 | 0.65 | ALDH1A1 (0.40) | ALDH1A1GLACYP2C19CNR2 | |
| Hydrochloric Acid SCHEMBL7517080 | 0.64 | ALDH1A1 (0.32) | ALDH1A1GLACYP2C19 | |
| SCHEMBL27482621 | 0.61 | DRD2 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0917464-A1 | USE OF AMINES TO PRODUCE DRUGS FOR PREVENTING TUMOUR CELL PROLIFERATION | SANOFI (FR) | 1999-05-26 | — | — | EP | disclosed |
| WO-1998004251-A1 | USE OF AMINES TO PRODUCE DRUGS FOR PREVENTING TUMOUR CELL PROLIFERATION | SANOFI (FR) | 1998-02-05 | — | — | WO | disclosed |