Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 11/20 | 0.57 |
| ▸ | MAOB | P27338 | 9/20 | 0.57 |
| ▸ | HTR2B | P41595 | 6/20 | 0.57 |
| ▸ | HTR2A | P28223 | 4/20 | 0.57 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 7/20 | 0.43 |
| ▸ | KDM1A | O60341 | 5/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL25254330 | 1.00 | HTR2C (0.57) | HTR2CMAOBHTR2BHTR2ADRD2 | |
| SCHEMBL13778 | 1.00 | HTR2C (0.57) | HTR2CMAOBHTR2BHTR2ADRD2 | |
| SCHEMBL6560505 | 0.81 | HTR2C (0.53) | HTR2CMAOBHTR2BHTR2ADRD2 | |
| SCHEMBL6250926 | 0.81 | KDM1A (0.43) | HTR2CMAOBHTR2BHTR2ADRD2 | |
| SCHEMBL3395704 | 0.80 | HTR2C (0.57) | HTR2CMAOBHTR2BHTR2ADRD2 | |
| SCHEMBL6584873 | 0.80 | HTR2C (0.57) | HTR2CMAOBHTR2BHTR2ADRD2 | |
| SCHEMBL10675977 | 0.79 | MEN1 (0.42) | HTR2CMAOBHTR2BHTR2AMAOA | |
| SCHEMBL10675972 | 0.79 | MEN1 (0.42) | HTR2CMAOBHTR2BHTR2AMAOA | |
| SCHEMBL6406073 | 0.79 | MEN1 (0.42) | HTR2CMAOBHTR2BHTR2AMAOA | |
| SCHEMBL10676736 | 0.79 | MEN1 (0.42) | HTR2CMAOBHTR2BHTR2AMAOA |
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-2483251-A2 | POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | Amira Pharmaceuticals, Inc. (US) | 2012-08-08 | — | — | EP | disclosed |
| WO-2011041462-A2 | POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS | AMIRA PHARMACEUTICALS, INC. (US) | 2011-04-07 | — | — | WO | disclosed |