Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.48 |
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | CASR | P41180 | 1/20 | 0.44 |
| ▸ | GBA1 | P04062 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9865729 | 0.90 | CA1 (0.45) | CA1CA2GBA1CYP3A4HDAC1 | |
| SCHEMBL9337513 | 0.87 | CA1 (0.44) | CA1CA2GBA1CYP3A4HDAC1 | |
| SCHEMBL1186353 | 0.81 | MEN1 (0.50) | CASRMEN1KMT2ANPC1RAB9A | |
| SCHEMBL31391106 | 0.80 | CA1 (0.62) | CA1CA2GBA1CYP3A4HDAC1 | |
| SCHEMBL9337501 | 0.80 | HDAC1 (0.40) | CA1CA2GBA1HDAC1HDAC3 | |
| SCHEMBL27545217 | 0.79 | MEN1 (0.55) | CASRL3MBTL1MEN1KMT2ANPC1 | |
| SCHEMBL9866697 | 0.79 | CA1 (0.64) | CA1CA2GBA1CYP3A4HDAC1 | |
| SCHEMBL3082583 | 0.78 | MEN1 (0.60) | CA1CA2GBA1CYP3A4HDAC1 | |
| SCHEMBL9865340 | 0.78 | L3MBTL1 (0.41) | CASRHDAC1HDAC3L3MBTL1HDAC4 | |
| SCHEMBL5243757 | 0.77 | CA1 (0.59) | CA1CA2GBA1CYP3A4HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5039805-A | Novel benzoic and phenylacetic acid derivatives | HOFFMANN-LA ROCHE INC. (US) | 1991-08-13 | — | — | US | disclosed |