Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 3/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.43 |
| ▸ | PDK3 | Q15120 | 3/20 | 0.43 |
| ▸ | PDK4 | Q16654 | 3/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL742856 | 0.88 | ALDH1A1 (0.39) | PDK1PDK2PDK3PDK4HDAC3 | |
| SCHEMBL28599363 | 0.84 | ALDH1A1 (0.44) | PDK1PDK2PDK3PDK4HDAC3 | |
| SCHEMBL31114495 | 0.81 | PDK1 (0.36) | PDK1PDK2PDK3PDK4HDAC3 | |
| Toluene SCHEMBL27973589 | 0.78 | TSHR (0.44) | PDK1PDK2PDK3PDK4MAPT | |
| SCHEMBL5716690 | 0.76 | KIF11 (0.45) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL15391808 | 0.75 | ALDH1A1 (0.36) | PDK1PDK2PDK3PDK4MAPT | |
| SCHEMBL10586608 | 0.72 | ALDH1A1 (0.33) | PDK1PDK2PDK3PDK4HDAC3 | |
| SCHEMBL11415130 | 0.71 | PDK1 (0.42) | PDK1PDK2PDK3PDK4HDAC1 | |
| SCHEMBL4832864 | 0.71 | HDAC1 (0.44) | PDK1PDK2PDK3PDK4HDAC3 | |
| Thiomorpholine SCHEMBL11884508 | 0.70 | CYP2D6 (0.32) | EPHX1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109535036-A | A kind of synthetic method of indoxacarb intermediate chloroformyl [4- (trifluoromethoxy) phenyl] methyl carbamate | 山东华阳农药化工集团有限公司 | 2019-03-29 | — | — | CN | disclosed |
| CN-109535036-A | A kind of synthetic method of indoxacarb intermediate chloroformyl [4- (trifluoromethoxy) phenyl] methyl carbamate | 山东华阳农药化工集团有限公司 | 2019-03-29 | — | — | CN | disclosed |