Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 2/20 | 0.47 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6760930 | 0.82 | CA1 (0.45) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL7180072 | 0.82 | TBXAS1 (0.56) | ALDH1A1HPGDHDAC3HDAC4HDAC1 | |
| SCHEMBL7180077 | 0.82 | TBXAS1 (0.56) | ALDH1A1HPGDHDAC3HDAC4HDAC1 | |
| SCHEMBL6760928 | 0.82 | CA1 (0.45) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL7180064 | 0.82 | TBXAS1 (0.56) | ALDH1A1HPGDHDAC3HDAC4HDAC1 | |
| SCHEMBL6760927 | 0.82 | CA1 (0.45) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL11623850 | 0.82 | CNR1 (0.46) | NQO2NR1I2ALDH1A1MAPTKDM4E | |
| SCHEMBL6763377 | 0.81 | CNR1 (0.46) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL6763375 | 0.81 | CNR1 (0.46) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL6763373 | 0.81 | CNR1 (0.46) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 |
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-1827678-B1 | METHOD AND APPARATUS FOR PERFORMING MICRO-SCALE CHEMICAL REACTIONS | TOTAL SYNTHESIS LTD (CA) | 2012-07-18 | — | — | EP | disclosed |
| US-20070212267-A1 | Method and apparatus for performing micro-scale chemical reactions | TOTAL SYNTHESIS LTD. (CA) | 2007-09-13 | — | — | US | disclosed |
| US-20070212267-A1 | Method and apparatus for performing micro-scale chemical reactions | TOTAL SYNTHESIS LTD. (CA) | 2007-09-13 | — | — | US | disclosed |