Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.63 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.63 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.62 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.56 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.55 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | DRD2 | P14416 | 1/20 | 0.54 |
| ▸ | DRD1 | P21728 | 1/20 | 0.54 |
| ▸ | DRD5 | P21918 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL3926715 | 0.94 | TMEM97 (0.62) | TMEM97SIGMAR1HRH3GRIN2BSLC6A2 | |
| SCHEMBL7397997 | 0.94 | TMEM97 (0.62) | TMEM97SIGMAR1HRH3GRIN2BSLC6A2 | |
| Hydrochloric Acid SCHEMBL7405954 | 0.93 | TMEM97 (0.61) | TMEM97SIGMAR1HRH3GRIN2BSLC6A2 | |
| Hydrochloric Acid SCHEMBL7295872 | 0.92 | TMEM97 (0.69) | TMEM97SIGMAR1HRH3SLC6A2SLC6A4 | |
| SCHEMBL7400101 | 0.87 | TMEM97 (0.70) | TMEM97SIGMAR1HRH3SLC6A2SLC6A4 | |
| SCHEMBL7380357 | 0.87 | GRIN2B (0.55) | TMEM97SIGMAR1GRIN2BMAOB | |
| Hydrochloric Acid SCHEMBL7406556 | 0.86 | TMEM97 (0.68) | TMEM97SIGMAR1HRH3SLC6A2SLC6A4 | |
| Benzoic Acid SCHEMBL7306640 | 0.84 | TMEM97 (0.65) | TMEM97SIGMAR1HRH3SLC6A2SLC6A4 | |
| SCHEMBL8814613 | 0.84 | HRH3 (0.66) | TMEM97SIGMAR1HRH3GRIN2BSLC6A2 | |
| SCHEMBL7406223 | 0.84 | SLC6A2 (0.57) | TMEM97SIGMAR1GRIN2BSLC6A2SLC6A4 |
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-2002030422-A1 | USE OF DEFINED SUBSTANCES THAT BIND TO THE SIGMA RECEPTOR FOR COMBATING SARCOMA AND CARCINOMA | MERCK PATENT GMBH (DE) | 2002-04-18 | — | — | WO | disclosed |