Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 8/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.32 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | CCR2 | P41597 | 1/20 | 0.32 |
| ▸ | KLK1 | P06870 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | MITF | O75030 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5380499 | 0.83 | PTAFR (0.39) | HDAC1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL3539202 | 0.76 | HDAC1 (0.57) | HDAC1HDAC10HDAC6HDAC3HDAC2 | |
| SCHEMBL5611501 | 0.70 | CYP1A2 (0.46) | HDAC1KDM4ESMN1; SMN2HDAC10HDAC6 | |
| SCHEMBL10055041 | 0.69 | ALDH1A1 (0.49) | HDAC1KDM4EMAPTKMT2AMEN1 | |
| SCHEMBL3540141 | 0.65 | HDAC1 (0.63) | HDAC1HDAC10HDAC6HDAC3HDAC2 | |
| SCHEMBL10453089 | 0.63 | ESR1 (0.49) | HDAC1KMT2AMEN1HDAC10HDAC6 | |
| SCHEMBL2362869 | 0.62 | HDAC1 (0.54) | HDAC1KMT2AMEN1HDAC10HDAC6 | |
| SCHEMBL16684997 | 0.61 | POLB (0.47) | KDM4EMAPTKMT2ASMN1; SMN2TDP1 | |
| SCHEMBL9767715 | 0.61 | CES2 (0.50) | MAPTKMT2ASMN1; SMN2HTTBACE1 | |
| SCHEMBL27482363 | 0.61 | CA1 (0.47) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1824831-A2 | HISTONE DEACETYLASE INHIBITORS | Takeda San Diego, Inc. (US) | 2007-08-29 | — | — | EP | disclosed |
| WO-2006066133-A2 | HISTONE DEACETYLASE INHIBITORS | TAKEDA SAN DIEGO, INC. (US) | 2006-06-22 | — | — | WO | disclosed |