Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.57 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.53 |
| ▸ | LTA4H | P09960 | 3/20 | 0.49 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.45 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.45 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1728748 | 0.90 | MCHR1 (0.66) | KCNH2MCHR1LTA4HACHETSHR | |
| SCHEMBL1728135 | 0.88 | LTA4H (0.51) | KCNH2MCHR1LTA4HTSHR | |
| SCHEMBL6081348 | 0.88 | LTA4H (0.51) | KCNH2MCHR1LTA4HTSHR | |
| SCHEMBL1728641 | 0.86 | GNRHR (0.48) | KCNH2MCHR1LTA4HTSHR | |
| SCHEMBL1728669 | 0.86 | LTA4H (0.68) | KCNH2MCHR1LTA4H | |
| SCHEMBL1728663 | 0.82 | LTA4H (0.44) | KCNH2MCHR1LTA4H | |
| SCHEMBL1728580 | 0.81 | LTA4H (0.51) | KCNH2MCHR1LTA4H | |
| SCHEMBL1729935 | 0.81 | MCHR1 (0.45) | KCNH2MCHR1LTA4H | |
| SCHEMBL4775058 | 0.80 | KCNH2 (0.79) | KCNH2LTA4HCACNA1FCHRM2ACHE | |
| SCHEMBL1729079 | 0.79 | GAA (0.62) | KCNH2DRD3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1551810-B1 | DIARYL-SUBSTITUTED CYCLIC UREA DERIVATIVES HAVING AN MCH-MODULATORY EFFECT | SANOFI AVENTIS DEUTSCHLAND (DE) | 2011-11-30 | — | — | EP | disclosed |
| 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 |