Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.41 |
| ▸ | ACACB | O00763 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | DRD4 | P21917 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6081904 | 0.97 | HRH3 (0.42) | HRH3ACACBKDM4EDRD2DRD4 | |
| SCHEMBL1728644 | 0.86 | HRH3 (0.42) | HRH3ACACBKDM4EALDH1A1MEN1 | |
| SCHEMBL1727849 | 0.84 | KDM4E (0.43) | HRH3ACACBKDM4EALDH1A1CYP1A2 | |
| SCHEMBL6081508 | 0.84 | KDM4E (0.50) | HRH3KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL1727601 | 0.83 | KDM4E (0.52) | HRH3KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL6081167 | 0.83 | MCHR1 (0.42) | HRH3ACACBKMT2A | |
| SCHEMBL1729087 | 0.81 | MAPK14 (0.51) | HRH3KDM4EALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL6081908 | 0.81 | ALDH1A1 (0.36) | HRH3ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL1728856 | 0.80 | HRH3 (0.42) | HRH3 | |
| SCHEMBL1728688 | 0.80 | LSS (0.48) | HRH3CYP1A2CYP2D6CYP2C19 |
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 |