Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5136969 | 0.91 | TSHR (0.48) | TSHRSMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL5137304 | 0.85 | SMN1; SMN2 (0.41) | TSHRSMN1; SMN2L3MBTL1MAPTMEN1 | |
| SCHEMBL5135704 | 0.80 | KMT2A (0.45) | TSHRSMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL5136129 | 0.79 | HTR2A (0.46) | TSHRSMN1; SMN2L3MBTL1HTR2AMAPT | |
| SCHEMBL5373300 | 0.79 | MEN1 (0.46) | TSHRSMN1; SMN2HTR2AMEN1KMT2A | |
| SCHEMBL5135771 | 0.78 | MEN1 (0.51) | TSHRSMN1; SMN2HTR2AMEN1KMT2A | |
| SCHEMBL6388406 | 0.77 | HTR2A (0.45) | TSHRSMN1; SMN2HTR2AMAPTMEN1 | |
| SCHEMBL5358561 | 0.77 | ALDH1A1 (0.47) | TSHRSMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL5074889 | 0.76 | HTR2A (0.41) | TSHRSMN1; SMN2HTR2AMAPTGAA | |
| SCHEMBL5361344 | 0.76 | ALDH1A1 (0.46) | TSHRSMN1; SMN2HTR2AMAPTGAA |
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 |