Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | GBA1 | P04062 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9865958 | 0.87 | CA1 (0.58) | CA1CA2ALDH1A1GBA1CYP3A4 | |
| SCHEMBL30787994 | 0.84 | CA1 (0.63) | CA1CA2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL22546955 | 0.84 | CA1 (0.63) | CA1CA2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL31203455 | 0.83 | CA1 (0.64) | CA1CA2ALDH1A1GBA1CYP3A4 | |
| SCHEMBL31391106 | 0.81 | CA1 (0.62) | CA1CA2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL4837793 | 0.81 | CA1 (0.63) | CA1CA2GBA1CYP3A4HDAC3 | |
| SCHEMBL9866032 | 0.80 | CA1 (0.50) | CA1CA2GBA1CYP3A4HDAC3 | |
| SCHEMBL1854623 | 0.80 | MAPT (0.54) | CA1ALDH1A1CYP2C9LMNATDP1 | |
| SCHEMBL30640612 | 0.80 | MAPT (0.54) | CA1ALDH1A1CYP2C9LMNATDP1 | |
| SCHEMBL9865135 | 0.80 | HTT (0.51) | CA1CA2ALDH1A1CYP2C9CYP2C19 |
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 |