Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 3/20 | 0.35 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | C5AR1 | P21730 | 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 | |
|---|---|---|---|---|
| SCHEMBL5135282 | 0.94 | ALDH1A1 (0.37) | ALDH1A1HTTSMN1; SMN2KDM4ENPSR1 | |
| SCHEMBL5134681 | 0.91 | KAT8 (0.41) | KDM4ETSHRAGTR1LTB4R2PPARG | |
| SCHEMBL5137569 | 0.88 | AGTR1 (0.35) | ALDH1A1HTTSMN1; SMN2KDM4ENPSR1 | |
| SCHEMBL5135175 | 0.87 | AGTR1 (0.43) | ALDH1A1SMN1; SMN2KDM4ETLR7AGTR1 | |
| SCHEMBL5135275 | 0.85 | LDHA (0.42) | TSHRAGTR1LTB4R2C5AR1 | |
| SCHEMBL5137555 | 0.85 | HTT (0.42) | ALDH1A1HTTSMN1; SMN2NPSR1MEN1 | |
| SCHEMBL5135244 | 0.82 | KDM4E (0.35) | ALDH1A1HTTKDM4ENPSR1MEN1 | |
| SCHEMBL5134636 | 0.81 | AGTR1 (0.46) | ALDH1A1KDM4EAGTR1 | |
| SCHEMBL5136696 | 0.81 | NPC1 (0.40) | ALDH1A1SMN1; SMN2MEN1LMNAKMT2A | |
| SCHEMBL5136085 | 0.81 | AGTR1 (0.45) | ALDH1A1SMN1; SMN2KDM4EAGTR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1490044-A4 | COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS | NEUROGEN CORP (US) | 2008-04-16 | — | — | EP | disclosed |
| EP-1490044-A1 | COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS | NEUROGEN CORPORATION (US) | 2004-12-29 | — | — | EP | disclosed |
| WO-2003084524-A1 | COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS | NEUROGEN CORPORATION (US) | 2003-10-16 | — | — | WO | disclosed |