Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.53 |
| ▸ | S1PR1 | P21453 | 10/20 | 0.53 |
| ▸ | S1PR3 | Q99500 | 10/20 | 0.53 |
| ▸ | S1PR2 | O95136 | 8/20 | 0.53 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.50 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7209237 | 0.91 | HTR2A (0.63) | HRH4HRH3S1PR1S1PR3S1PR2 | |
| Acetic Acid SCHEMBL9008894 | 0.91 | S1PR1 (0.58) | HRH4HRH3S1PR1S1PR3S1PR2 | |
| Acetic Acid SCHEMBL9008751 | 0.88 | S1PR1 (0.52) | HRH4HRH3S1PR1S1PR3S1PR2 | |
| SCHEMBL11934723 | 0.88 | HRH4 (0.61) | HRH4HRH3S1PR1S1PR3S1PR2 | |
| SCHEMBL14524279 | 0.87 | HRH4 (0.53) | HRH4HRH3S1PR1S1PR3S1PR2 | |
| SCHEMBL10045140 | 0.87 | HRH4 (0.63) | HRH4HRH3S1PR1S1PR3S1PR2 | |
| SCHEMBL11934799 | 0.86 | HRH4 (0.59) | HRH4HRH3S1PR1S1PR3S1PR2 | |
| Acetic Acid SCHEMBL9008753 | 0.86 | S1PR1 (0.53) | HRH4HRH3S1PR1S1PR3S1PR2 | |
| SCHEMBL13975764 | 0.85 | HRH4 (0.60) | HRH4HRH3S1PR1S1PR3S1PR2 | |
| SCHEMBL13093971 | 0.85 | HRH4 (0.66) | HRH4HRH3S1PR1S1PR3S1PR2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995028179-A1 | CONTRAST AGENTS FOR DIAGNOSTIC IMAGING | METASYN, INC. (US) | 1995-10-26 | — | — | WO | disclosed |