Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 3/20 | 0.37 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8554610 | 1.00 | SIGMAR1 (0.39) | SIGMAR1ADRA2AHTR2AMAOBMAOA | |
| SCHEMBL9583897 | 0.93 | SIGMAR1 (0.39) | SIGMAR1ADRA2AHTR2AMAOBMAOA | |
| SCHEMBL75539 | 0.85 | HTR2A (0.43) | HTR2AMAOBMAOATAAR1RET | |
| SCHEMBL8558010 | 0.82 | S1PR1 (0.41) | SIGMAR1ADRA2AMAOBMAOA | |
| SCHEMBL9583432 | 0.78 | HTR2A (0.38) | SIGMAR1HTR2AMAOBMAOATAAR1 | |
| SCHEMBL8559759 | 0.77 | KDM1A (0.41) | HTR2AKDM1AHTR2C | |
| SCHEMBL5326427 | 0.77 | MME (0.38) | SIGMAR1MAOBMAOAPARP1 | |
| SCHEMBL8651098 | 0.75 | ADRA2A (0.48) | ADRA2AHTR2ATAAR1KDM1AHTR1A | |
| SCHEMBL7913143 | 0.75 | HTR1A (0.33) | HTR2AHTR1AHTR1BHTR2CHTR7 | |
| SCHEMBL3644143 | 0.75 | SIGMAR1 (0.43) | SIGMAR1HTR2ATSHRHTR2C |
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 |