Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 15/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 9/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 7/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 8/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | INSR | P06213 | 1/20 | 0.31 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.31 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27704577 | 0.79 | HDAC1 (0.38) | HDAC1HDAC6HDAC8HDAC3HDAC2 | |
| SCHEMBL27704595 | 0.78 | HDAC1 (0.58) | HDAC1HDAC6HDAC8HDAC3HDAC2 | |
| SCHEMBL27704601 | 0.77 | HDAC1 (0.51) | HDAC1HDAC6HDAC8HDAC3HDAC2 | |
| SCHEMBL27725269 | 0.75 | HDAC1 (0.47) | HDAC1HDAC6HDAC8HDAC3HDAC2 | |
| SCHEMBL28773431 | 0.75 | HDAC1 (0.47) | HDAC1HDAC6HDAC8HDAC3HDAC2 | |
| SCHEMBL27704596 | 0.75 | HDAC1 (0.41) | HDAC1HDAC6HDAC8HDAC3HDAC2 | |
| SCHEMBL27725330 | 0.75 | HDAC1 (0.47) | HDAC1HDAC6HDAC8HDAC3HDAC2 | |
| SCHEMBL27704569 | 0.73 | RAB9A (0.43) | HDAC1HDAC6HDAC8HDAC3HDAC2 | |
| SCHEMBL27885648 | 0.69 | HDAC2 (0.53) | HDAC1HDAC6HDAC8HDAC3HDAC2 | |
| SCHEMBL27656909 | 0.69 | HDAC2 (0.53) | HDAC1HDAC6HDAC8HDAC3HDAC2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101137623-A | N-sulphonylpyrroles and their use as histone deacetylase inhibitors | NYCOMED GMBH (DE) | 2008-03-05 | — | — | CN | claimed |
| CN-101137623-B | N-sulphonylpyrroles and use thereof as histone deacetylase inhibitors | NYCOMED GMBH | 2013-03-27 | — | — | CN | disclosed |
| CN-101137623-A | N-sulphonylpyrroles and their use as histone deacetylase inhibitors | NYCOMED GMBH (DE) | 2008-03-05 | — | — | CN | disclosed |