Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 17/20 | 0.61 |
| ▸ | HDAC2 | Q92769 | 11/20 | 0.61 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.61 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.61 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.61 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.61 |
| ▸ | KDM1A | O60341 | 1/20 | 0.61 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | INSR | P06213 | 1/20 | 0.45 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | PLK1 | P53350 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | RARB | P10826 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3433183 | 1.00 | HDAC1 (0.61) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL5611097 | 0.85 | HDAC1 (0.59) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL5611088 | 0.85 | HDAC1 (0.59) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL15961403 | 0.85 | HDAC1 (0.61) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL15961402 | 0.85 | HDAC1 (0.61) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL3146261 | 0.84 | HDAC1 (0.69) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL3146271 | 0.84 | HDAC1 (0.69) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL296419 | 0.84 | HDAC1 (0.79) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL296420 | 0.84 | HDAC1 (0.79) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL5611418 | 0.83 | HDAC1 (0.58) | HDAC1HDAC2HDAC3HDAC10HDAC11 |
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 |
|---|---|---|---|---|---|---|---|
| US-7666868-B2 | e.g. N-Hydroxy-3-{1-[4-(1-methyl-1H-indol-5-yl)-benzenesulfonyl]-1H-pyrrol-3-yl}-acrylamide; antiproliferative, anticarcinogenic, antiinflammatory, neuroleptic agent, autoimmune disorders | 4SC AG (DE) | 2010-02-23 | — | — | US | claimed |