Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TNF | P01375 | 4/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13504952 | 0.81 | HDAC6 (0.41) | HDAC6TSHRMAPK1TNFHDAC3 | |
| SCHEMBL4782862 | 0.81 | HDAC6 (0.51) | HDAC6TSHRMAPK1TNFHDAC3 | |
| SCHEMBL4796792 | 0.76 | HDAC6 (0.48) | HDAC6TSHRMAPK1TNFHDAC3 | |
| SCHEMBL19645655 | 0.75 | HDAC6 (0.51) | HDAC6TSHRMAPK1TNFHDAC3 | |
| SCHEMBL4725517 | 0.75 | ELANE (0.50) | HDAC6HTTEGFRATM | |
| SCHEMBL4781276 | 0.74 | ACVR1 (0.44) | HDAC6TSHRMAPK1TNFGAA | |
| SCHEMBL4783088 | 0.74 | HDAC6 (0.43) | HDAC6TSHRMAPK1TNFHDAC3 | |
| SCHEMBL4781320 | 0.74 | HDAC6 (0.55) | HDAC6TSHRMAPK1TNFHDAC3 | |
| SCHEMBL1227184 | 0.72 | HDAC6 (0.60) | HDAC6TNFHDAC3HDAC4HDAC1 | |
| SCHEMBL5124722 | 0.71 | HDAC6 (0.62) | HDAC6TNFHDAC3HDAC4HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008020302-A2 | HETEROAROMATIC QUINOLINE-BASED COMPOUNDS AS PHOSPHODIESTERASE (PDE) INHIBITORS | PFIZER PRODUCTS INC. (US) | 2008-02-21 | — | — | WO | disclosed |