Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.63 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.63 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.63 |
| ▸ | HTR6 | P50406 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 6/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 4/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | CRHBP | P24387 | 1/20 | 0.55 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30691806 | 0.88 | HDAC1 (0.52) | HDAC8HDAC1HDAC6HTR6MAPT | |
| SCHEMBL30691740 | 0.83 | HDAC8 (0.60) | HDAC8HDAC1HDAC6HTR6MAPT | |
| SCHEMBL11010923 | 0.83 | MAPT (0.63) | HDAC8HDAC1HDAC6HTR6MAPT | |
| SCHEMBL13580985 | 0.81 | HDAC1 (0.54) | HDAC8HDAC1HDAC6HTR6KDM4E | |
| SCHEMBL30691785 | 0.81 | HDAC8 (0.59) | HDAC8HDAC1HDAC6HTR6MAPT | |
| SCHEMBL6555026 | 0.81 | HDAC8 (0.59) | HDAC8HDAC1HDAC6HTR6MAPT | |
| SCHEMBL22000063 | 0.81 | MAPT (0.81) | HDAC8HDAC1HDAC6HTR6MAPT | |
| SCHEMBL30691665 | 0.81 | HDAC8 (0.59) | HDAC8HDAC1HDAC6HTR6MAPT | |
| SCHEMBL2877032 | 0.80 | GBA1 (0.57) | HDAC8HDAC1HDAC6HTR6MAPT | |
| SCHEMBL24727558 | 0.79 | HDAC8 (0.56) | HDAC8HDAC1HDAC6HTR6MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-110563657-B | 1- (2, 6-Dichlorophenyl) -3-substituted urea colon cancer inhibitor and preparation and application thereof | 温州医科大学 | 2024-05-03 | — | — | CN | disclosed |
| CN-110396066-B | 1- (3, 5-dimethoxy phenyl) -3-substituted urea colon cancer inhibitor and preparation and application thereof | 温州医科大学 | 2023-12-19 | — | — | CN | disclosed |