Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PFKFB3 | Q16875 | 3/20 | 0.55 |
| ▸ | FABP4 | P15090 | 3/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.36 |
| ▸ | POLQ | O75417 | 1/20 | 0.36 |
| ▸ | PKLR | P30613 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15055421 | 0.90 | PFKFB3 (0.57) | PFKFB3FABP4HDAC3HDAC4HDAC1 | |
| SCHEMBL15055585 | 0.87 | PFKFB3 (0.62) | PFKFB3FABP4HDAC3HDAC4HDAC1 | |
| SCHEMBL9997131 | 0.84 | PFKFB3 (0.76) | PFKFB3FABP4PKMMAPTIDH1 | |
| SCHEMBL30268499 | 0.84 | PFKFB3 (0.76) | PFKFB3FABP4PKMMAPTIDH1 | |
| SCHEMBL15080000 | 0.78 | PFKFB3 (0.52) | PFKFB3FABP4PKMMAPTSMN1; SMN2 | |
| SCHEMBL15058769 | 0.78 | PFKFB3 (0.73) | PFKFB3PKMMAPTTSHRSMN1; SMN2 | |
| SCHEMBL15080044 | 0.76 | PFKFB3 (0.49) | PFKFB3FABP4HDAC3HDAC4HDAC1 | |
| Trifluoroacetic Acid SCHEMBL16393839 | 0.75 | PFKFB3 (0.49) | PFKFB3FABP4PKM | |
| SCHEMBL15059401 | 0.75 | PFKFB3 (0.48) | PFKFB3FABP4HDAC3HDAC4HDAC1 | |
| SCHEMBL15058582 | 0.74 | PFKFB3 (0.82) | PFKFB3PKMMAPTTSHRSMN1; SMN2 |
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-2794009-B1 | BISARYLSULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION AND CANCER | KANCERA AB (SE) | 2017-08-30 | — | — | EP | disclosed |