Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.39 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.39 |
| ▸ | PAM | P19021 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1662586 | 1.00 | CYP1A2 (0.46) | CYP1A2CYP2C19HDAC3HDAC4HDAC1 | |
| SCHEMBL1662556 | 0.78 | HTR2A (0.42) | CYP1A2CYP2C19HDAC3HDAC4HDAC1 | |
| SCHEMBL1662560 | 0.78 | HTR2A (0.42) | CYP1A2CYP2C19HDAC3HDAC4HDAC1 | |
| SCHEMBL15441091 | 0.76 | MEN1 (0.46) | CYP1A2CYP2C19HDAC3HDAC4HDAC1 | |
| SCHEMBL13458401 | 0.76 | MEN1 (0.46) | CYP1A2CYP2C19HDAC3HDAC4HDAC1 | |
| SCHEMBL13841244 | 0.76 | MEN1 (0.46) | CYP1A2CYP2C19HDAC3HDAC4HDAC1 | |
| SCHEMBL15184733 | 0.76 | MEN1 (0.46) | CYP1A2CYP2C19HDAC3HDAC4HDAC1 | |
| SCHEMBL31436266 | 0.74 | CYP1A2 (0.56) | CYP1A2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL21716147 | 0.74 | EGFR (0.47) | CYP1A2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4379058 | 0.73 | CYP1A2 (0.44) | CYP1A2CYP2C19HDAC3HDAC4HDAC1 |
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-2011050284-A1 | PYRAZOLYLPYRIDINE ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2011-04-28 | — | — | WO | disclosed |