Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7650053 | 0.80 | HDAC1 (0.52) | HDAC1HDAC8HDAC6HDAC11TP53 | |
| SCHEMBL7648551 | 0.80 | HDAC1 (0.51) | HDAC1HDAC8HDAC6HDAC11P2RX7 | |
| SCHEMBL7648583 | 0.79 | HDAC1 (0.59) | HDAC1HDAC8HDAC6HDAC11TP53 | |
| SCHEMBL7654891 | 0.77 | PTGS2 (0.41) | HDAC1HDAC8HDAC6HDAC11TP53 | |
| SCHEMBL7654886 | 0.75 | HDAC1 (0.48) | HDAC1HDAC8HDAC6HDAC11TP53 | |
| SCHEMBL7648478 | 0.73 | HDAC1 (0.40) | HDAC1HDAC8HDAC6MEN1KMT2A | |
| SCHEMBL11133208 | 0.73 | MEN1 (0.56) | HDAC1HDAC8HDAC6HDAC11TP53 | |
| SCHEMBL7654277 | 0.73 | CCR2 (0.45) | HDAC1HDAC8HDAC6HDAC11TP53 | |
| SCHEMBL7648500 | 0.73 | HDAC1 (0.45) | HDAC1HDAC8HDAC6HDAC11TP53 | |
| SCHEMBL7648333 | 0.73 | HDAC6 (0.48) | HDAC1HDAC8HDAC6HDAC11TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-6407116-B1 | 2,4-DIOXO-1,2,3,4-TETRAHYDROQUINAZOLINE DERIVATIVES; ANTIALLERGENS, ANTIASTHMATICS, ANTIHISTAMINES, AND ANTIINFLAMMATORY AGENTS | TAKEDA CHEMICAL INDUSTRIES, INC. (JP) | 2002-06-18 | — | — | US | disclosed |
| EP-1026160-A1 | NITROGENOUS FUSED-RING COMPOUNDS, PROCESS FOR THE PREPARATION OF THE SAME, AND DRUGS | Takeda Chemical Industries, Ltd. (JP) | 2000-08-09 | — | — | EP | disclosed |