Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.43 |
| ▸ | TNKS | O95271 | 1/20 | 0.43 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.38 |
| ▸ | CA4 | P22748 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9845559 | 1.00 | HCAR2 (0.43) | HCAR2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL9330870 | 1.00 | HCAR2 (0.43) | HCAR2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL22701997 | 0.81 | TBXA2R (0.40) | MAPTALDH1A1KDM4ELMNAPKM | |
| SCHEMBL22701986 | 0.80 | ALDH1A1 (0.40) | HCAR2CA1CA2MAPTALDH1A1 | |
| SCHEMBL6912141 | 0.79 | ALDH1A1 (0.32) | ALDH1A1CYP3A4TDP1 | |
| SCHEMBL6912142 | 0.79 | ALDH1A1 (0.32) | ALDH1A1CYP3A4TDP1 | |
| SCHEMBL22701962 | 0.76 | MAPT (0.50) | HCAR2CA1CA2MAPTALDH1A1 | |
| Fumaric Acid SCHEMBL12230954 | 0.73 | HCAR2 (0.50) | HCAR2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL22702012 | 0.72 | MAPT (0.54) | NFKB1MAPTALDH1A1KDM4ECYP2C19 | |
| SCHEMBL777022 | 0.71 | — | — |
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-0408108-A2 | Pharmaceutical compositions containing acrylic acid derivatives and their use in the medicine | RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) | 1991-01-16 | — | — | EP | disclosed |