Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 7/20 | 0.37 |
| ▸ | CTSS | P25774 | 4/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL22526271 | 0.82 | CA1 (0.49) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL26656189 | 0.82 | CA1 (0.49) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL26656193 | 0.82 | CA1 (0.49) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL26205581 | 0.82 | CA1 (0.49) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL2840815 | 0.81 | CA1 (0.44) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL15228678 | 0.78 | CTSK (0.43) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL20701884 | 0.78 | CTSK (0.43) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL15228429 | 0.78 | CTSK (0.43) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL26656112 | 0.78 | CTSK (0.43) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL22526366 | 0.77 | CA2 (0.43) | CA1CA2CA7CYP2D6CTSK |
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-0145875-A2 | Gamma-aminobutyric acid transaminase inhibitors and processes for their preparation | MERRELL DOW PHARMACEUTICALS INC. (US) | 1985-06-26 | — | — | EP | disclosed |