Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | CASR | P41180 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL9180894 | 1.00 | TAAR1 (0.34) | TAAR1ALDH1A1SIGMAR1CYP3A4CHRM2 | |
| SCHEMBL12203625 | 0.77 | HTR2A (0.37) | TAAR1SIGMAR1ADRA2ASMN1; SMN2MEN1 | |
| SCHEMBL1587083 | 0.75 | CYP3A4 (0.39) | TAAR1ALDH1A1SIGMAR1CYP3A4CHRM2 | |
| SCHEMBL8557856 | 0.73 | PLK1 (0.35) | TAAR1ALDH1A1SIGMAR1GRM7SMN1; SMN2 | |
| SCHEMBL9260996 | 0.73 | PLK1 (0.35) | TAAR1ALDH1A1SIGMAR1GRM7SMN1; SMN2 | |
| SCHEMBL8556244 | 0.72 | SIGMAR1 (0.41) | ALDH1A1SIGMAR1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL9517420 | 0.71 | HTR2A (0.37) | TAAR1SIGMAR1ADRA2AOPRM1SMN1; SMN2 | |
| SCHEMBL31066736 | 0.67 | MTOR (0.43) | TAAR1CYP3A4GRM7ALOX15 | |
| SCHEMBL27899990 | 0.65 | NPFFR1 (0.38) | TAAR1CYP3A4LMNACYP1A2CYP2D6 | |
| SCHEMBL9519923 | 0.65 | HTR2A (0.44) | TAAR1SIGMAR1ADRA2ADRD1DRD3 |
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-0635497-B1 | Benzospiroalkene derivatives, process for their preparation and pharmaceutical compostions containing them | ADIR (FR) | 1998-05-20 | — | — | EP | disclosed |
| EP-0635497-A2 | Benzospiroalkene derivatives, process for their preparation and pharmaceutical compostions containing them | ADIR ET COMPAGNIE (FR) | 1995-01-25 | — | — | EP | disclosed |