Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | RYR2 | Q92736 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6082053 | 0.84 | BTK (0.42) | HRH3HTR1AADRA1DADRA1B | |
| SCHEMBL6081904 | 0.81 | HRH3 (0.42) | ALDH1A1TSHRHRH3MEN1KMT2A | |
| SCHEMBL1727601 | 0.81 | KDM4E (0.52) | ALDH1A1HRH3HPGDMEN1KMT2A | |
| SCHEMBL6081179 | 0.81 | HRH3 (0.41) | ALDH1A1HRH3MEN1KMT2ANPC1 | |
| SCHEMBL6081508 | 0.80 | KDM4E (0.50) | ALDH1A1TSHRHRH3HPGDMEN1 | |
| SCHEMBL1728644 | 0.80 | HRH3 (0.42) | ALDH1A1TSHRHRH3MEN1KMT2A | |
| SCHEMBL1727849 | 0.78 | KDM4E (0.43) | ALDH1A1HRH3 | |
| SCHEMBL1728856 | 0.76 | HRH3 (0.42) | HRH3 | |
| SCHEMBL1729124 | 0.75 | LSS (0.47) | HRH3 | |
| SCHEMBL1729760 | 0.75 | LSS (0.47) | HRH3 |
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-7141561-B2 | Substituted diaryl heterocycles, process for their preparation and their use as medicaments | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2006-11-28 | — | — | US | disclosed |