Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.40 |
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | KDM1A | O60341 | 4/20 | 0.36 |
| ▸ | PREP | P48147 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.32 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.32 |
| ▸ | ITGAL | P20701 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL642256 | 0.87 | CES2 (0.46) | CES2CES1KDM1ACTSLITGB2 | |
| SCHEMBL642255 | 0.87 | CES2 (0.46) | CES2CES1KDM1ACTSLITGB2 | |
| SCHEMBL7242129 | 0.78 | PBRM1 (0.44) | CES2CES1ITGB2ICAM1ITGAL | |
| SCHEMBL21163487 | 0.78 | ACHE (0.41) | CES2CES1KDM1AGRIN2DGRIN3B | |
| SCHEMBL8381824 | 0.76 | ALDH1A1 (0.43) | GRIN2BLMNAALDH1A1CYP3A4TSHR | |
| SCHEMBL6571700 | 0.76 | RORB (0.36) | CES2CES1KDM1AGRIN2DGRIN3B | |
| SCHEMBL8376594 | 0.75 | KDM1A (0.34) | KDM1A | |
| SCHEMBL164708 | 0.75 | CES2 (0.54) | CES2CES1PREPCRBNITGB2 | |
| SCHEMBL7952512 | 0.75 | CES2 (0.43) | CES2CES1PREPCRBNITGB2 | |
| SCHEMBL8381060 | 0.74 | CES2 (0.35) | CES2CES1KDM1ACTSLITGB2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5883102-A | Pharmaceutically active compounds | ASTRA PHARMACEUTICALS LIMITED (GB) | 1999-03-16 | — | — | US | disclosed |