Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.63 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.63 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.62 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.62 |
| ▸ | TNF | P01375 | 1/20 | 0.62 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.62 |
| ▸ | HTT | P42858 | 4/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 5/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3969678 | 0.82 | CYP11B1 (0.71) | HDAC1HDAC8CYP11B1CYP11B2TNF | |
| SCHEMBL13907295 | 0.80 | CYP11B1 (0.89) | HDAC1CYP11B1CYP11B2TNFHDAC6 | |
| SCHEMBL1750364 | 0.80 | HDAC1 (0.73) | HDAC1CYP11B1CYP11B2TNFHDAC6 | |
| SCHEMBL230002 | 0.79 | CYP11B1 (1.00) | HDAC1CYP11B1CYP11B2TNFHDAC6 | |
| SCHEMBL31357411 | 0.79 | CYP11B1 (1.00) | HDAC1CYP11B1CYP11B2TNFHDAC6 | |
| SCHEMBL17942160 | 0.78 | CYP11B1 (0.69) | HDAC1CYP11B1CYP11B2TNFHDAC6 | |
| SCHEMBL3368462 | 0.77 | HDAC1 (1.00) | HDAC1HDAC8HDAC6 | |
| SCHEMBL3368458 | 0.77 | HDAC1 (1.00) | HDAC1HDAC8HDAC6 | |
| SCHEMBL12850040 | 0.76 | HDAC6 (1.00) | HDAC1HDAC8CYP11B1CYP11B2TNF | |
| SCHEMBL7672864 | 0.76 | CYP11B1 (0.75) | HDAC1CYP11B1CYP11B2TNFHDAC6 |
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-2004063169-A1 | HYDROXAMID ACID DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS | ASTELLAS PHARMA INC. (JP) | 2004-07-29 | — | — | WO | disclosed |