Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | CCNT1 | O60563 | 5/20 | 0.51 |
| ▸ | CDK2 | P24941 | 5/20 | 0.51 |
| ▸ | CDK9 | P50750 | 5/20 | 0.51 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.51 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.49 |
| ▸ | CDK1 | P06493 | 1/20 | 0.48 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.48 |
| ▸ | CDK7 | P50613 | 1/20 | 0.48 |
| ▸ | CCNH | P51946 | 1/20 | 0.48 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.48 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.47 |
| ▸ | JAK2 | O60674 | 2/20 | 0.47 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.47 |
| ▸ | JAK1 | P23458 | 1/20 | 0.46 |
| ▸ | JAK3 | P52333 | 1/20 | 0.46 |
| ▸ | TTBK1 | Q5TCY1 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL22990854 | 0.75 | CDK2 (0.51) | HDAC3HDAC1HDAC2HDAC6CCNT1 | |
| SCHEMBL5502283 | 0.74 | HDAC3 (0.58) | HDAC3HDAC1HDAC2HDAC6CCNT1 | |
| SCHEMBL519704 | 0.72 | HDAC3 (0.58) | HDAC3HDAC1HDAC2HDAC6CCNT1 | |
| SCHEMBL29371274 | 0.71 | CDK2 (0.62) | HDAC3HDAC1HDAC2HDAC6CCNT1 | |
| SCHEMBL12614697 | 0.71 | HDAC3 (0.64) | HDAC3HDAC1HDAC2HDAC6CCNT1 | |
| SCHEMBL4730099 | 0.70 | HDAC6 (1.00) | HDAC3HDAC1HDAC2HDAC6CCNT1 | |
| SCHEMBL20516550 | 0.69 | RIPK2 (0.71) | HDAC3HDAC1HDAC2HDAC6CCNT1 | |
| SCHEMBL18376719 | 0.69 | MAP4K1 (0.62) | HDAC3HDAC1HDAC2HDAC6CCNT1 | |
| SCHEMBL15824558 | 0.69 | HDAC3 (0.59) | HDAC3HDAC1HDAC2HDAC6CCNT1 | |
| SCHEMBL17465885 | 0.68 | DCLK1 (0.72) | RIPK2PLK4BRD4 |
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-2935248-B1 | COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR | PLEXXIKON INC (US) | 2018-02-28 | — | — | EP | disclosed |