Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19507338 | 0.83 | ALDH1A1 (0.46) | ALDH1A1IDO1TDO2ACHEHDAC1 | |
| SCHEMBL18304927 | 0.76 | BRPF1 (0.55) | ALDH1A1IDO1TDO2HDAC1HDAC8 | |
| SCHEMBL12313570 | 0.76 | ACHE (0.50) | ALDH1A1IDO1TDO2ACHEMAPT | |
| SCHEMBL16956140 | 0.75 | CYP1A2 (0.46) | ALDH1A1IDO1TDO2ACHEHDAC6 | |
| SCHEMBL31540608 | 0.75 | ALDH1A1 (0.44) | ALDH1A1ACHEHDAC1HDAC8HDAC6 | |
| SCHEMBL8280908 | 0.74 | FFAR4 (0.43) | ALDH1A1IDO1TDO2ACHEMAPT | |
| SCHEMBL18579354 | 0.72 | ALDH1A1 (0.57) | ALDH1A1IDO1TDO2HDAC1HDAC8 | |
| SCHEMBL23271722 | 0.71 | ACHE (0.40) | ALDH1A1IDO1TDO2ACHEMAPT | |
| SCHEMBL16955509 | 0.71 | ACHE (0.40) | ALDH1A1IDO1TDO2ACHEMAPT | |
| SCHEMBL16372665 | 0.71 | ALDH1A1 (0.61) | ALDH1A1IDO1TDO2ACHEPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-106565593-B | A kind of preparation method of Ceritinib intermediate | 常州市勇毅生物药业有限公司 | 2019-03-01 | — | — | CN | claimed |
| CN-106565593-B | A kind of preparation method of Ceritinib intermediate | 常州市勇毅生物药业有限公司 | 2019-03-01 | — | — | CN | disclosed |
| CN-106565593-B | A kind of preparation method of Ceritinib intermediate | 常州市勇毅生物药业有限公司 | 2019-03-01 | — | — | CN | disclosed |