Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 7/20 | 0.73 |
| ▸ | HTR1A | P08908 | 6/20 | 0.73 |
| ▸ | ADRA1D | P25100 | 6/20 | 0.73 |
| ▸ | ADRA1B | P35368 | 6/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | DRD3 | P35462 | 6/20 | 0.52 |
| ▸ | DRD2 | P14416 | 5/20 | 0.52 |
| ▸ | DRD4 | P21917 | 4/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.51 |
| ▸ | DRD1 | P21728 | 1/20 | 0.51 |
| ▸ | DRD5 | P21918 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.51 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | FAAH | O00519 | 1/20 | 0.49 |
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 SCHEMBL8876536 | 0.99 | ADRA1A (0.72) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL8877112 | 0.95 | HTR1A (0.68) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL8875919 | 0.89 | HTR1A (0.78) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL8876383 | 0.88 | HTR1A (0.69) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL8875779 | 0.88 | HTR1A (0.69) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL8876730 | 0.87 | HTR1A (0.64) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL8876455 | 0.87 | ADRA1A (0.75) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| Hydrochloric Acid SCHEMBL27348716 | 0.86 | ADRA1A (0.74) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL8874490 | 0.86 | HTR1A (0.66) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 | |
| SCHEMBL8875603 | 0.86 | HTR1A (0.68) | ADRA1AHTR1AADRA1DADRA1BALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5605896-A | Bicyclic heterocyclic derivatives having α1 adrenergic and 5HT1A activities | RECORDATI S.A., CHEMICAL AND PHARMACEUTICAL COMPANY (CH) | 1997-02-25 | — | — | US | claimed |