Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 1/20 | 0.52 |
| ▸ | HTR6 | P50406 | 4/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | FAAH | O00519 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3354629 | 0.80 | HTR6 (0.48) | HTR6CYP1A2KDM4EALDH1A1HPGD | |
| SCHEMBL13537344 | 0.80 | HTR6 (0.45) | HTR6CYP1A2KDM4EALDH1A1HPGD | |
| SCHEMBL31324652 | 0.79 | HTR7 (0.54) | HTR7CYP1A2 | |
| SCHEMBL1122379 | 0.79 | HTR7 (0.58) | HTR7HTR6CHRNB4CHRNA3 | |
| SCHEMBL7805941 | 0.79 | HTR7 (0.53) | HTR7CYP1A2KDM4EALDH1A1HPGD | |
| SCHEMBL15712191 | 0.78 | HTR7 (0.54) | HTR7CNR2ALDH1A1 | |
| SCHEMBL3357957 | 0.78 | HTR7 (0.63) | HTR7HRH3ALDH1A1 | |
| SCHEMBL3312100 | 0.78 | HTR7 (0.57) | HTR7TDP1CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL3354696 | 0.77 | HTR7 (0.58) | HTR7HTR6CYP1A2ALDH1A1CYP2D6 | |
| SCHEMBL2266077 | 0.75 | NOS3 (0.57) | HTR7DRD2HRH3KDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2141163-A1 | Substituted thiazolidinones, their production and utilisation as medicine | Bayer Schering Pharma AG (DE) | 2010-01-06 | — | — | EP | disclosed |