Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.44 |
| ▸ | DRD3 | P35462 | 4/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3960510 | 0.85 | TRPA1 (0.39) | DRD2DRD3ADRA2CLMNACHRM1 | |
| SCHEMBL1568098 | 0.84 | DRD2 (0.51) | DRD2DRD3LMNAHTR1AHTR2A | |
| SCHEMBL5809604 | 0.84 | DRD2 (0.46) | DRD2DRD3ADRA2CLMNACHRM1 | |
| Hydrochloric Acid SCHEMBL1773502 | 0.83 | DRD2 (0.50) | DRD2LMNAHTR1AHTR2AHTR3A | |
| Hydrochloric Acid SCHEMBL4234715 | 0.83 | DRD2 (0.50) | DRD2LMNAHTR1AHTR2AHTR3A | |
| SCHEMBL905217 | 0.78 | DRD2 (0.60) | DRD2DRD3ADRA2CLMNACHRM1 | |
| SCHEMBL3685628 | 0.78 | HRH4 (0.51) | DRD2DRD3ADRA2CLMNACHRM1 | |
| Hydrochloric Acid SCHEMBL5606159 | 0.77 | HRH4 (0.50) | DRD2DRD3ADRA2CLMNACHRM1 | |
| SCHEMBL5563082 | 0.76 | HTR2A (0.46) | DRD2DRD3ADRA2CLMNACHRM1 | |
| SCHEMBL5329365 | 0.76 | DRD2 (0.46) | DRD2DRD3ADRA2CLMNACHRM1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009002507-A1 | COMPOSITIONS AND METHODS FOR TREATING MEDICAL CONDITIONS | COMBINATORX, INCORPORATED (US) | 2008-12-31 | — | — | WO | disclosed |
| WO-2008085927-A2 | METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF PAIN | COMBINATORX, INCORPORATED (US) | 2008-07-17 | — | — | WO | disclosed |
| EP-1691744-A4 | METHODS AND REAGENTS FOR THE TREATMENT OF INFLAMMATORY DISORDERS | COMBINATORX INC (US) | 2007-12-26 | — | — | EP | disclosed |
| EP-1691744-A2 | METHODS AND REAGENTS FOR THE TREATMENT OF INFLAMMATORY DISORDERS | CombinatoRx, Incorporated (US) | 2006-08-23 | — | — | EP | disclosed |
| WO-2005048927-A2 | METHODS AND REAGENTS FOR THE TREATMENT OF INFLAMMATORY DISORDERS | COMBINATORX, INCORPORATED (US) | 2005-06-02 | — | — | WO | disclosed |