Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 9/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 9/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 9/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 9/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 9/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 9/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 9/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 9/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 9/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 9/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 9/20 | 0.45 |
| ▸ | GRM4 | Q14833 | 3/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3584492 | 0.79 | HDAC3 (0.40) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL12673343 | 0.79 | HDAC3 (0.40) | HDAC3HDAC4HDAC1HDAC7HDAC2 | |
| SCHEMBL13499177 | 0.76 | KCNA5 (0.43) | ALDH1A1HPGDSMN1; SMN2HTT | |
| SCHEMBL12337628 | 0.76 | SMN1; SMN2 (0.47) | ALDH1A1HPGDSMN1; SMN2NPC1RAB9A | |
| SCHEMBL6328702 | 0.70 | CTSD (0.50) | ALDH1A1HPGDSMN1; SMN2MAPTHTT | |
| SCHEMBL27484400 | 0.70 | TRIM24 (0.38) | ALDH1A1HPGDSMN1; SMN2CYP1A2MAPT | |
| SCHEMBL13985020 | 0.70 | MAPT (0.50) | ALDH1A1SMN1; SMN2MAPTCYP2C9HTT | |
| SCHEMBL11892791 | 0.70 | KMT2A (0.41) | HDAC8ALDH1A1HPGDSMN1; SMN2CYP1A2 | |
| SCHEMBL11821772 | 0.70 | TRIM24 (0.44) | ALDH1A1HPGDSMN1; SMN2CYP1A2MAPT | |
| SCHEMBL13985162 | 0.68 | NPSR1 (0.56) | NAMPTALDH1A1HPGDSMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2113500-A1 | MAPK/ERK kinase inhibitors | Takeda Pharmaceutical Company Limited (JP) | 2009-11-04 | — | — | EP | disclosed |