Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 6/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.34 |
| ▸ | BACE1 | P56817 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9515919 | 0.78 | KDM1A (0.40) | KDM1ASLC6A4SLC6A3HTR2AHTR2C | |
| SCHEMBL8556517 | 0.77 | SIGMAR1 (0.39) | KDM1AHTR2AHTR2C | |
| SCHEMBL8554610 | 0.77 | SIGMAR1 (0.39) | KDM1AHTR2AHTR2C | |
| SCHEMBL9583897 | 0.75 | SIGMAR1 (0.39) | KDM1AHTR2AHTR2C | |
| SCHEMBL8556494 | 0.72 | KDM1A (0.41) | KDM1AHTR2AHTR2CHTR2BPNMT | |
| Hydrochloric Acid SCHEMBL9517486 | 0.71 | KDM1A (0.40) | KDM1ASLC6A4SLC6A3HTR2AHTR2C | |
| SCHEMBL7976327 | 0.70 | KDM1A (0.45) | KDM1ASLC6A4SLC6A3HTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL9518179 | 0.69 | SLC6A4 (0.39) | KDM1ASLC6A4SLC6A3HTR2AHTR2C | |
| SCHEMBL8651098 | 0.69 | ADRA2A (0.48) | KDM1AHTR2AHTR2CPNMT | |
| SCHEMBL15962624 | 0.66 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0635497-B1 | Benzospiroalkene derivatives, process for their preparation and pharmaceutical compostions containing them | ADIR (FR) | 1998-05-20 | — | — | EP | disclosed |
| US-5436261-A | Adrenergic agonists | ADIR ET COMPAGNIE (FR) | 1995-07-25 | — | — | US | disclosed |
| EP-0635497-A2 | Benzospiroalkene derivatives, process for their preparation and pharmaceutical compostions containing them | ADIR ET COMPAGNIE (FR) | 1995-01-25 | — | — | EP | disclosed |