Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL111602 | 0.82 | CA14 (0.40) | CA14HDAC6NFKB1NFKB2RELA | |
| SCHEMBL1843886 | 0.78 | EPHX1 (0.38) | CA14HDAC6 | |
| SCHEMBL1462541 | 0.78 | CA14 (0.37) | CA14HDAC6NFKB1NFKB2RELA | |
| SCHEMBL20018290 | 0.76 | CA14 (0.36) | CA14HDAC6NFKB1NFKB2RELA | |
| SCHEMBL376711 | 0.75 | ALDH1A1 (0.37) | CA14HDAC6NFKB1NFKB2RELA | |
| SCHEMBL12327588 | 0.75 | HDAC6 (0.37) | CA14HDAC6NFKB1NFKB2RELA | |
| SCHEMBL8236157 | 0.75 | CA14 (0.36) | CA14HDAC6NFKB1NFKB2RELA | |
| SCHEMBL1094539 | 0.74 | CA14 (0.32) | CA14 | |
| SCHEMBL1583503 | 0.72 | CA14 (0.37) | CA14HDAC6HDAC1HDAC2 | |
| SCHEMBL3019714 | 0.72 | CA14 (0.43) | CA14HDAC6NFKB1NFKB2RELA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019112457-A1 | DOPAMINE-Β-HYDROXYLASE INHIBITORS | BIAL - PORTELA & Cª, S.A. (PT) | 2019-06-13 | — | — | WO | disclosed |