Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | NAMPT | P43490 | 3/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.34 |
| ▸ | SNCA | P37840 | 1/20 | 0.34 |
| ▸ | QPCT | Q16769 | 1/20 | 0.33 |
| ▸ | HPN | P05981 | 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 | |
|---|---|---|---|---|
| SCHEMBL18667131 | 0.84 | CYP11B1 (0.43) | HDAC1HDAC3CYP11B1CYP11B2NAMPT | |
| SCHEMBL18667383 | 0.84 | PTPN11 (0.41) | HDAC1HDAC3CYP11B1CYP11B2NAMPT | |
| SCHEMBL18667423 | 0.83 | CYP11B1 (0.49) | HDAC1HDAC3CYP11B1CYP11B2NAMPT | |
| SCHEMBL18667617 | 0.80 | — | — | |
| SCHEMBL18667483 | 0.80 | CYP2C19 (0.39) | HDAC1HDAC3CYP11B1CYP11B2 | |
| SCHEMBL18667084 | 0.80 | KMT2A (0.47) | HDAC1HDAC3CA1CA2CA4 | |
| SCHEMBL18667642 | 0.80 | ALDH1A1 (0.44) | HDAC1 | |
| SCHEMBL30560687 | 0.79 | HDAC1 (0.57) | XDHHDAC1HDAC3CYP11B1CYP11B2 | |
| SCHEMBL21229129 | 0.79 | NAMPT (0.44) | XDHEPHX2HDAC1HDAC3NAMPT | |
| SCHEMBL18641439 | 0.78 | EPHX2 (0.47) | XDHEPHX2CA1CA2CA4 |
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-2017048950-A1 | HEPATITIS B CORE PROTEIN MODULATORS | ASSEMBLY BIOSCIENCES, INC. (US) | 2017-03-23 | — | — | WO | disclosed |