Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.55 |
| ▸ | MC4R | P32245 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MPO | P05164 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3454127 | 0.86 | HDAC3 (0.56) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1482081 | 0.86 | HDAC3 (0.56) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| Hydrochloric Acid SCHEMBL30279971 | 0.84 | HDAC3 (0.55) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4878350 | 0.84 | HDAC3 (0.55) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| Hydrochloric Acid SCHEMBL17338492 | 0.84 | HDAC3 (0.55) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL15058449 | 0.84 | HDAC3 (0.55) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| Lithium Ion SCHEMBL15058448 | 0.83 | HDAC3 (0.54) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL6585398 | 0.82 | HDAC3 (0.56) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL11819060 | 0.82 | HDAC3 (0.53) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL10533979 | 0.81 | CYP2A13 (0.59) | SMN1; SMN2ALDH1A1KDM4EKMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-103848813-B | The preparation method of imatinib | 北大方正集团有限公司 | 2016-08-03 | — | — | CN | disclosed |