Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19289692 | 0.91 | SIGMAR1 (0.43) | SIGMAR1HTR2ADRD2ADRA1DADRA1A | |
| SCHEMBL19852352 | 0.82 | SIGMAR1 (0.40) | SIGMAR1HTR2ADRD2ADRA1DADRA1A | |
| SCHEMBL7440977 | 0.80 | SIGMAR1 (0.45) | SIGMAR1HTR2ADRD2ADRA1DADRA1A | |
| SCHEMBL10962460 | 0.76 | AKT1 (0.44) | SIGMAR1HTR2ADRD2ADRA1DADRA1A | |
| SCHEMBL27636984 | 0.75 | SIGMAR1 (0.41) | SIGMAR1HTR2ADRD2ADRA1DADRA1A | |
| SCHEMBL6921400 | 0.74 | SIGMAR1 (0.43) | SIGMAR1HTR2ADRD2ADRA1DADRA1A | |
| SCHEMBL8038088 | 0.74 | TSHR (0.43) | SIGMAR1HTR2AADRA1BMAOAMAOB | |
| SCHEMBL15075010 | 0.74 | SIGMAR1 (0.45) | SIGMAR1HTR2ADRD2ADRA1DADRA1A | |
| Hydrochloric Acid SCHEMBL6924162 | 0.73 | SIGMAR1 (0.42) | SIGMAR1HTR2ADRD2ADRA1DADRA1A | |
| SCHEMBL27486394 | 0.72 | SIGMAR1 (0.35) | SIGMAR1HTR2ADRD2HTR2CKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5506246-A | Method for treating depression using substituted aminomethyltetralins and their heterocyclic analogues | BAYER AKTIENGESELLSCHAFT (DE) | 1996-04-09 | — | — | US | disclosed |
| US-5300523-A | Binding serotonin receptors, treating nervous system disorders | BAYER AKTIENGESELLSCHAFT (DE) | 1994-04-05 | — | — | US | disclosed |
| US-5137901-A | For binding 5-HT 1 receptors; treating central nervous system disorders | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-11 | — | — | US | disclosed |