Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 12/20 | 0.65 |
| ▸ | HDAC3 | O15379 | 9/20 | 0.65 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 2/20 | 0.33 |
| ▸ | HPGDS | O60760 | 1/20 | 0.32 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.31 |
| ▸ | MMP8 | P22894 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL15745568 | 0.92 | HDAC1 (0.75) | HDAC1HDAC3HDAC6CYP1A2CYP3A4 | |
| SCHEMBL15580186 | 0.79 | HDAC1 (1.00) | HDAC1HDAC3HDAC6HDAC8ABCB1 | |
| SCHEMBL19114024 | 0.79 | HDAC1 (1.00) | HDAC1HDAC3HDAC6HDAC8ABCB1 | |
| SCHEMBL19114239 | 0.78 | HDAC1 (0.53) | HDAC1HDAC3HDAC6CYP1A2CYP3A4 | |
| SCHEMBL15580192 | 0.75 | HDAC1 (0.79) | HDAC1HDAC3HDAC6HDAC8MMP13 | |
| SCHEMBL15580193 | 0.74 | HDAC1 (0.89) | HDAC1HDAC3HDAC6HDAC8MMP13 | |
| SCHEMBL15580223 | 0.72 | HDAC3 (1.00) | HDAC1HDAC3HDAC6HDAC8 | |
| SCHEMBL15580229 | 0.72 | HDAC1 (1.00) | HDAC1HDAC3HDAC6HDAC8 | |
| SCHEMBL15580289 | 0.67 | HDAC1 (0.86) | HDAC1HDAC3HDAC6HDAC8 | |
| SCHEMBL13297066 | 0.67 | RAB9A (0.59) | HDAC1HDAC3HDAC6CYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2708534-A1 | THIAZOLE COMPOUND AND PREPARATION METHOD AND USE THEREOF | Shanghai Puyi Chemical Co., Ltd. (CN) | 2014-03-19 | — | — | EP | disclosed |