Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 4/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | GLRA1 | P23415 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GSR | P00390 | 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 | |
|---|---|---|---|---|
| SCHEMBL275427 | 0.69 | CA1 (1.00) | CA1CA2GAAGABRA1GABRB1 | |
| SCHEMBL5261044 | 0.67 | LMNA (0.44) | HTTLMNAALDH1A1 | |
| SCHEMBL5558001 | 0.67 | MAOB (0.40) | CYP3A4ALDH1A1 | |
| SCHEMBL2225565 | 0.66 | CDC25A (0.35) | ALDH1A1 | |
| SCHEMBL1375987 | 0.65 | BACE1 (0.44) | GAAHTTALDH1A1 | |
| SCHEMBL5940544 | 0.64 | GABRP (0.37) | GAAGABRA1GABRB1GABRB2CYP1A2 | |
| SCHEMBL9257799 | 0.62 | CA12 (0.38) | CA1CA2CYP3A4LMNA | |
| SCHEMBL28839082 | 0.62 | CA1 (0.58) | CA1CA2GAAGABRA1GABRB1 | |
| SCHEMBL17323097 | 0.62 | CA1 (0.81) | CA1CA2GAAGABRA1GABRB1 | |
| SCHEMBL9285114 | 0.61 | — | — |
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-5464865-A | Enzyme inhibitors as antiinflammatory agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1995-11-07 | — | — | US | disclosed |