Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 1/20 | 0.37 |
| ▸ | CMA1 | P23946 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL625952 | 0.78 | LMNA (0.48) | PGRMAOBHTR1ADRD2HTR2A | |
| SCHEMBL625846 | 0.78 | MAOB (0.43) | PGRMAOBHTR1ADRD2HTR2A | |
| SCHEMBL12867047 | 0.77 | MAOB (0.51) | PGRMAOBHTR1ADRD2HTR2A | |
| SCHEMBL627485 | 0.73 | MAOB (0.39) | PGRMAOBHTR1ADRD2HTR2A | |
| SCHEMBL20496339 | 0.70 | MAOB (0.46) | PGRMAOBHTR1ADRD2HTR2A | |
| SCHEMBL12881773 | 0.70 | MAOB (0.52) | PGRMAOBHTR1ADRD2HTR2A | |
| SCHEMBL11602317 | 0.70 | BLM (0.51) | PGRMAOBHTR1ADRD2HTR2A | |
| SCHEMBL12727792 | 0.70 | MAOB (0.55) | PGRMAOBHTR1ADRD2HTR2A | |
| Hydrochloric Acid SCHEMBL11601519 | 0.69 | BLM (0.50) | PGRMAOBHTR1ADRD2HTR2A | |
| SCHEMBL28967631 | 0.69 | BRD4 (0.60) | PGRMAOBBRD4LMNACDK2 |
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-2603079-A1 | POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 | Merck Sharp & Dohme Corp. (US) | 2013-06-19 | — | — | EP | claimed |
| WO-2012021382-A1 | POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 | MERCK SHARP & DOHME CORP. (US) | 2012-02-16 | — | — | WO | claimed |