Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.44 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | S100B | P04271 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14206353 | 0.88 | GAA (0.46) | GAAALDH1A1MAPTLMNACYP1A2 | |
| SCHEMBL13786603 | 0.88 | MAOB (0.53) | GAAALDH1A1MAPTLMNACYP1A2 | |
| SCHEMBL14035606 | 0.88 | GAA (0.46) | GAAALDH1A1MAPTLMNACYP1A2 | |
| SCHEMBL13786667 | 0.88 | ALDH1A1 (0.48) | GAAALDH1A1MAPTLMNACYP1A2 | |
| SCHEMBL14221547 | 0.86 | GAA (0.47) | GAAALDH1A1MAPTLMNACYP1A2 | |
| SCHEMBL13971352 | 0.85 | ALDH1A1 (0.46) | GAAALDH1A1MAPTLMNACYP1A2 | |
| SCHEMBL13971251 | 0.85 | ALDH1A1 (0.47) | GAAALDH1A1MAPTLMNACYP1A2 | |
| SCHEMBL10536605 | 0.79 | S100B (0.62) | GAAALDH1A1MAPTLMNACYP1A2 | |
| SCHEMBL10536609 | 0.79 | S100B (0.62) | GAAALDH1A1MAPTLMNACYP1A2 | |
| SCHEMBL4733326 | 0.78 | MAOB (0.70) | GAAALDH1A1MAPTMAOBHDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008057948-A2 | PROCESSES FOR PRODUCTION OF DIPHENYLYLAZETIDIN-2-ONES AND RELATED COMPOUNDS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2008-05-15 | — | — | WO | disclosed |