Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | IDH1 | O75874 | 1/20 | 0.44 |
| ▸ | ERN1 | O75460 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | BRAF | P15056 | 4/20 | 0.43 |
| ▸ | RAF1 | P04049 | 2/20 | 0.42 |
| ▸ | CCNC | P24863 | 1/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 2/20 | 0.41 |
| ▸ | IDH2 | P48735 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14783119 | 1.00 | HDAC3 (0.44) | HDAC3HDAC2IDH1ERN1MAPT | |
| SCHEMBL15689112 | 0.94 | ERN1 (0.46) | HDAC3HDAC2IDH1ERN1MAPT | |
| SCHEMBL16786677 | 0.92 | MEN1 (0.45) | MAPTMEN1KMT2ABRAFPOLB | |
| SCHEMBL15688915 | 0.91 | IDH1 (0.47) | HDAC3HDAC2IDH1ERN1MAPT | |
| SCHEMBL14783483 | 0.91 | RAF1 (0.49) | MAPTBRAFRAF1IDH2 | |
| SCHEMBL29590204 | 0.91 | RAF1 (0.49) | MAPTBRAFRAF1IDH2 | |
| SCHEMBL29590369 | 0.90 | HDAC3 (0.51) | HDAC3HDAC2ERN1MAPTMEN1 | |
| SCHEMBL14784095 | 0.90 | HDAC3 (0.51) | HDAC3HDAC2ERN1MAPTMEN1 | |
| SCHEMBL15689006 | 0.89 | HDAC3 (0.46) | HDAC3HDAC2IDH1ERN1MAPT | |
| SCHEMBL29592532 | 0.89 | HDAC3 (0.49) | HDAC3HDAC2MAPTHDAC1TP53 |
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-115403531-A | Chemical entities, compositions, and methods as kinase inhibitors | 润新生物公司 | 2022-11-29 | — | — | CN | disclosed |
| CN-108794411-B | Certain chemical entities, compositions, and methods | 润新生物公司 | 2022-06-07 | — | — | CN | disclosed |