Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 6/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.48 |
| ▸ | DRD4 | P21917 | 3/20 | 0.44 |
| ▸ | HTR2B | P41595 | 3/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | HTR5A | P47898 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL8261662 | 0.75 | TMEM97 (0.53) | TMEM97SIGMAR1ADRA2AADRA2BADRA2C | |
| SCHEMBL27312578 | 0.70 | SLC6A2 (0.43) | ADRA2AHTR2BHTR1AHTR2CSLC6A3 | |
| SCHEMBL30073105 | 0.70 | SIGMAR1 (0.60) | TMEM97SIGMAR1ADRA2AADRA2BADRA2C | |
| SCHEMBL3885452 | 0.69 | DDB1 (0.41) | — | |
| SCHEMBL3871805 | 0.68 | TMEM97 (0.52) | TMEM97SIGMAR1ADRA2AADRA2BADRA2C | |
| SCHEMBL3871008 | 0.68 | SIGMAR1 (0.46) | TMEM97SIGMAR1ADRA2AADRA2BADRA2C | |
| SCHEMBL6672942 | 0.68 | SIGMAR1 (0.62) | TMEM97SIGMAR1ADRA2AADRA2BADRA2C | |
| SCHEMBL9314619 | 0.67 | SIGMAR1 (0.55) | TMEM97SIGMAR1ADRA2AADRA2BADRA2C | |
| SCHEMBL4224135 | 0.67 | SIGMAR1 (0.55) | TMEM97SIGMAR1ADRA2AADRA2BADRA2C | |
| SCHEMBL3872119 | 0.67 | SIGMAR1 (0.55) | TMEM97SIGMAR1ADRA2AADRA2BADRA2C |
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-1848694-B1 | HETEROCYCLIC SUBSTITUTED PHENYL METHANONES AS INHIBITORS OF THE GLYCINE TRANSPORTER 1 | HOFFMANN LA ROCHE (CH) | 2009-11-25 | — | — | EP | disclosed |
| WO-2006082001-A1 | HETEROCYCLIC SUBSTITUTED PHENYL METHANONES AS INHIBITORS OF THE GLYCINE TRANSPORTER 1 | F.HOFFMANN-LA ROCHE AG (CH) | 2006-08-10 | — | — | WO | disclosed |