Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.54 |
| ▸ | HPGDS | O60760 | 1/20 | 0.52 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.48 |
| ▸ | KDM5A | P29375 | 2/20 | 0.48 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8326744 | 0.90 | HDAC1 (0.56) | CYP3A4CYP2D6CYP2C19CYP2E1CYP2A6 | |
| SCHEMBL8318730 | 0.89 | TBXAS1 (0.60) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL8322937 | 0.87 | CYP3A4 (0.49) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL8325909 | 0.82 | HDAC4 (0.55) | TBXAS1CYP3A4CYP2D6CYP2C19CYP2E1 | |
| SCHEMBL8170143 | 0.80 | CYP19A1 (0.48) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL8170145 | 0.80 | CYP19A1 (0.48) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL1346083 | 0.79 | HPGDS (0.77) | CYP3A4CYP2D6CYP2C19LMNACYP2E1 | |
| SCHEMBL3439435 | 0.78 | MEN1 (0.65) | MEN1KMT2ANPC1RAB9AGAA | |
| SCHEMBL5758431 | 0.77 | HPGDS (0.64) | CYP3A4CYP2D6CYP2C19LMNAMEN1 | |
| SCHEMBL8319688 | 0.76 | TBXAS1 (0.46) | TBXAS1CYP3A4CYP2D6CYP2C19CYP2E1 |
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 |