Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.49 |
| ▸ | TMEM97 | Q5BJF2 | 4/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.47 |
| ▸ | DRD4 | P21917 | 2/20 | 0.47 |
| ▸ | HTR2B | P41595 | 2/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | HTR5A | P47898 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8122252 | 0.82 | HDAC1 (0.55) | HDAC1KCNH2SIGMAR1TMEM97ADRA2A | |
| Hydrochloric Acid SCHEMBL7040966 | 0.81 | HDAC1 (0.54) | HDAC1KCNH2SIGMAR1TMEM97ADRA2A | |
| Hydrochloric Acid SCHEMBL7041877 | 0.81 | HDAC1 (0.54) | HDAC1KCNH2SIGMAR1TMEM97ADRA2A | |
| Hydrochloric Acid SCHEMBL7041875 | 0.79 | HDAC1 (0.53) | HDAC1KCNH2SIGMAR1TMEM97ADRA2A | |
| SCHEMBL7041614 | 0.79 | OPRM1 (0.64) | HDAC1KCNH2SIGMAR1TMEM97ADRA2A | |
| SCHEMBL30073105 | 0.77 | SIGMAR1 (0.60) | HDAC1KCNH2SIGMAR1TMEM97ADRA2A | |
| SCHEMBL3692387 | 0.76 | ESR1 (0.58) | HDAC1KCNH2SIGMAR1TMEM97ADRA2A | |
| SCHEMBL1205833 | 0.76 | ACACB (0.55) | HDAC1KCNH2SIGMAR1TMEM97ADRA2A | |
| SCHEMBL1206388 | 0.75 | SIGMAR1 (0.54) | HDAC1KCNH2SIGMAR1TMEM97ADRA2A | |
| SCHEMBL31514906 | 0.75 | SIGMAR1 (0.54) | HDAC1KCNH2SIGMAR1TMEM97ADRA2A |
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 |