Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | DRD5 | P21918 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | POLA1 | P09884 | 2/20 | 0.40 |
| ▸ | PRNP | P04156 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | HTR5A | P47898 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
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 SCHEMBL7822802 | 0.99 | ADRA2A (0.57) | ADRA2ASMN1; SMN2DRD2DRD1DRD5 | |
| Hydrochloric Acid SCHEMBL7816122 | 0.99 | ADRA2A (0.57) | ADRA2ASMN1; SMN2DRD2DRD1DRD5 | |
| Hydrochloric Acid SCHEMBL7827227 | 0.99 | ADRA2A (0.57) | ADRA2ASMN1; SMN2DRD2DRD1DRD5 | |
| Hydrochloric Acid SCHEMBL7831175 | 0.84 | ADRA2A (0.43) | ADRA2ASMN1; SMN2ADRA2BHRH1 | |
| SCHEMBL9049906 | 0.80 | ADRA2A (0.55) | ADRA2ASMN1; SMN2DRD2DRD1DRD5 | |
| Hydrochloric Acid SCHEMBL7815957 | 0.80 | ALDH1A1 (0.49) | ADRA2AHTR2CHTR2B | |
| Hydrochloric Acid SCHEMBL7826706 | 0.79 | ADRA2A (0.54) | ADRA2ASMN1; SMN2DRD2DRD1DRD5 | |
| Hydrochloric Acid SCHEMBL29051753 | 0.78 | ADRA2A (0.56) | ADRA2ADRD2DRD1DRD5DRD3 | |
| Hydrochloric Acid SCHEMBL30468426 | 0.78 | ADRA2A (0.56) | ADRA2ADRD2DRD1DRD5DRD3 | |
| Hydrochloric Acid SCHEMBL8841918 | 0.77 | DRD2 (0.38) | ADRA2ADRD2DRD1DRD5DRD3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0712845-B1 | Amine compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2001-10-17 | — | — | EP | disclosed |
| US-5633248-A | GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS, DIARYLALKYLIDENEDIAMINES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-05-27 | — | — | US | disclosed |
| EP-0712845-A1 | Amine compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-05-22 | — | — | EP | disclosed |
| EP-0670313-A1 | Spiro compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-09-06 | — | — | EP | disclosed |