Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTBP2 | P56545 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL12498657 | 1.00 | CTBP2 (0.44) | CTBP2CNR2CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL12498668 | 0.85 | PIK3CA (0.42) | CNR2CES1 | |
| SCHEMBL12498667 | 0.85 | PIK3CA (0.42) | CNR2CES1 | |
| SCHEMBL12499754 | 0.84 | KMT2A (0.40) | L3MBTL1MAPTLMNAPOLBMEN1 | |
| SCHEMBL12499758 | 0.84 | KMT2A (0.40) | L3MBTL1MAPTLMNAPOLBMEN1 | |
| SCHEMBL12498765 | 0.83 | CTBP2 (0.50) | CTBP2L3MBTL1SMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL12498763 | 0.83 | CTBP2 (0.50) | CTBP2L3MBTL1SMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL12500080 | 0.79 | CTBP2 (0.44) | CTBP2CNR2CYP2C9CYP2C19L3MBTL1 | |
| SCHEMBL12500078 | 0.79 | CTBP2 (0.44) | CTBP2CNR2CYP2C9CYP2C19L3MBTL1 | |
| Trifluoroacetic Acid SCHEMBL5659578 | 0.76 | CA2 (0.50) | CTBP2CNR2CYP2C9CYP2C19L3MBTL1 |
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-2012103071-A2 | COMPOUNDS AND COMPOSITIONS | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2012-08-02 | — | — | WO | disclosed |