Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 20/20 | 0.70 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.54 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.54 |
| ▸ | HTR1D | P28221 | 1/20 | 0.54 |
| ▸ | HTR2C | P28335 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | DRD3 | P35462 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.54 |
| ▸ | HTR5A | P47898 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6230714 | 0.94 | MCHR1 (0.68) | MCHR1 | |
| Trifluoroacetic Acid SCHEMBL6230511 | 0.91 | MCHR1 (0.80) | MCHR1 | |
| Trifluoroacetic Acid SCHEMBL5936030 | 0.90 | MCHR1 (0.73) | MCHR1 | |
| Trifluoroacetic Acid SCHEMBL5936208 | 0.90 | MCHR1 (0.87) | MCHR1 | |
| Trifluoroacetic Acid SCHEMBL5936148 | 0.89 | MCHR1 (0.73) | MCHR1 | |
| Trifluoroacetic Acid SCHEMBL5936122 | 0.89 | MCHR1 (0.76) | MCHR1 | |
| Trifluoroacetic Acid SCHEMBL5935999 | 0.89 | MCHR1 (0.76) | MCHR1 | |
| Trifluoroacetic Acid SCHEMBL5936062 | 0.88 | MCHR1 (0.65) | MCHR1CHRM4CYP3A4CHRM5ADRA2A | |
| Trifluoroacetic Acid SCHEMBL5936000 | 0.86 | MCHR1 (0.85) | MCHR1 | |
| Trifluoroacetic Acid SCHEMBL5936008 | 0.86 | MCHR1 (0.71) | MCHR1KCNH2 |
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-2004092181-A9 | HETEROCYCLIC MCHR1 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-01-27 | — | — | WO | disclosed |