Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.66 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.58 |
| ▸ | CHKA | P35790 | 4/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | MC4R | P32245 | 1/20 | 0.54 |
| ▸ | BTK | Q06187 | 1/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | NCF1 | P14598 | 1/20 | 0.50 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL25391576 | 0.87 | HDAC1 (0.61) | HDAC6HRH3HDAC1HDAC8ALDH1A1 | |
| SCHEMBL14123716 | 0.86 | HDAC6 (0.64) | HDAC6HRH3CHKALMNAMC4R | |
| SCHEMBL28061494 | 0.85 | HDAC6 (0.71) | HDAC6HRH3CHKALMNAMC4R | |
| Bromide SCHEMBL14054339 | 0.84 | HDAC6 (0.62) | HDAC6HRH3CHKALMNAMC4R | |
| SCHEMBL65179 | 0.83 | HDAC6 (0.69) | HDAC6HRH3CHKALMNAMC4R | |
| SCHEMBL1482327 | 0.83 | HDAC6 (0.69) | HDAC6HRH3CHKALMNAMC4R | |
| SCHEMBL1174 | 0.83 | HDAC6 (0.69) | HDAC6HRH3CHKALMNAMC4R | |
| SCHEMBL12966235 | 0.83 | HDAC6 (0.69) | HDAC6HRH3CHKALMNAMC4R | |
| SCHEMBL16356429 | 0.83 | HDAC6 (0.69) | HDAC6HRH3CHKALMNAMC4R | |
| SCHEMBL5839834 | 0.83 | HDAC6 (0.69) | HDAC6HRH3CHKALMNAMC4R |
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-109641890-A | Isocitric dehydrogenase (IDH) inhibitor | 上海迈同生物科技有限公司 | 2019-04-16 | — | — | CN | disclosed |