Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRA | P11474 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.41 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10119818 | 0.91 | SLC6A4 (0.46) | ESRRASLC6A4PRMT5WDR77HDAC6 | |
| SCHEMBL10119828 | 0.87 | SLC6A4 (0.46) | ESRRASLC6A4PRMT5WDR77HDAC6 | |
| SCHEMBL8138142 | 0.84 | SLC6A4 (0.65) | ESRRASLC6A4HDAC6HDAC3HDAC1 | |
| SCHEMBL10119878 | 0.83 | SLC6A4 (0.43) | ESRRASLC6A4PRMT5WDR77HDAC6 | |
| SCHEMBL10119834 | 0.80 | ESRRA (0.41) | ESRRAPRMT5WDR77KDM1A | |
| SCHEMBL8270041 | 0.77 | SLC6A4 (0.43) | ESRRASLC6A4PRMT5WDR77HDAC6 | |
| SCHEMBL10119682 | 0.76 | SLC6A4 (0.44) | ESRRASLC6A4PRMT5WDR77HDAC6 | |
| SCHEMBL8269988 | 0.76 | CDK2 (0.43) | SLC6A4PRMT5WDR77HDAC6HDAC3 | |
| SCHEMBL10119803 | 0.74 | PRMT5 (0.43) | ESRRASLC6A4PRMT5WDR77CHRM1 | |
| SCHEMBL8270943 | 0.74 | MTNR1A (0.47) | SLC6A4EP300 |
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-1781639-B1 | SUBSTITUTED INDOLYL ALKYL AMINO DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE | JANSSEN PHARMACEUTICA NV (BE) | 2012-01-25 | — | — | EP | disclosed |