Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.32 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 2/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20985583 | 0.83 | CA14 (0.34) | HDAC6HDAC1HDAC2CACNA1GCACNA1B | |
| SCHEMBL1456149 | 0.78 | HDAC6 (0.38) | HDAC6HDAC1HDAC2CACNA1GCACNA1B | |
| SCHEMBL20033588 | 0.78 | HDAC6 (0.38) | HDAC6HDAC1HDAC2CACNA1GCACNA1B | |
| SCHEMBL15584545 | 0.77 | HDAC6 (0.38) | HDAC6HDAC1HDAC2CACNA1GCACNA1B | |
| SCHEMBL14443433 | 0.77 | HDAC6 (0.38) | HDAC6HDAC1HDAC2CACNA1GCACNA1B | |
| SCHEMBL2917271 | 0.75 | HDAC6 (0.39) | HDAC6HDAC1HDAC2AAK1DPP4 | |
| SCHEMBL16846576 | 0.74 | HDAC6 (0.34) | HDAC6HDAC1HDAC2CACNA1GCACNA1B | |
| SCHEMBL20934891 | 0.74 | CA14 (0.35) | HDAC6HDAC1HDAC2CACNA1GCACNA1B | |
| SCHEMBL15597130 | 0.74 | CYP2D6 (0.33) | HDAC6HDAC1HDAC2CYP2D6AAK1 | |
| SCHEMBL25901934 | 0.74 | CA14 (0.35) | HDAC6HDAC1HDAC2CACNA1GCACNA1B |
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-3129372-B1 | AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C | CANCER RESEARCH TECH LTD (GB) | 2020-12-16 | — | — | EP | disclosed |