Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 2/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.54 |
| ▸ | CA1 | P00915 | 2/20 | 0.54 |
| ▸ | CA2 | P00918 | 2/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA7 | P43166 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL196223 | 0.87 | CA12 (0.68) | HDAC4HDAC2HDAC8CA1CA2 | |
| 1,2,4-Trimethoxybenzene SCHEMBL2496227 | 0.86 | CA12 (0.75) | CA1CA2CA12CA7CA9 | |
| SCHEMBL7332669 | 0.82 | L3MBTL1 (0.48) | HDAC4HDAC2HDAC8CA1CA2 | |
| SCHEMBL29482636 | 0.78 | L3MBTL1 (0.64) | CA1CA2CA12CA7CA9 | |
| SCHEMBL407215 | 0.78 | L3MBTL1 (0.64) | CA1CA2CA12CA7CA9 | |
| SCHEMBL2532255 | 0.78 | CA1 (0.63) | CA1CA2CA12CA7CA9 | |
| 1,4-Dimethoxybenzene SCHEMBL5960077 | 0.78 | CA1 (0.65) | CA1CA2CA12CA7CA9 | |
| SCHEMBL16109474 | 0.78 | HDAC4 (0.65) | HDAC4HDAC2HDAC8CA1CA2 | |
| SCHEMBL29899709 | 0.77 | CA12 (0.60) | HDAC4HDAC2HDAC8CA1CA2 | |
| SCHEMBL21794142 | 0.77 | HDAC4 (0.49) | HDAC4HDAC2HDAC8CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1169730-A | Aromatic heterocyclic derivatives as enzyme inhibitors | CORVAS INT INC (US) | 1998-01-07 | — | — | CN | disclosed |