Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 17/20 | 0.49 |
| ▸ | KLK1 | P06870 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15759268 | 0.84 | KLKB1 (0.51) | KLKB1KLK1HSD17B10ALDH1A1 | |
| SCHEMBL16246747 | 0.81 | KLKB1 (0.49) | KLKB1KLK1HSD17B10 | |
| SCHEMBL13813853 | 0.81 | KCNH2 (0.53) | KLKB1HSD17B10ALDH1A1 | |
| SCHEMBL17232474 | 0.81 | KLKB1 (0.49) | KLKB1KLK1HSD17B10 | |
| SCHEMBL15033959 | 0.79 | KLKB1 (0.51) | KLKB1KLK1HSD17B10 | |
| SCHEMBL13102481 | 0.79 | KLKB1 (0.54) | KLKB1KLK1 | |
| SCHEMBL16246702 | 0.79 | KLKB1 (0.48) | KLKB1KLK1HSD17B10ALDH1A1 | |
| SCHEMBL27239076 | 0.79 | KLKB1 (0.65) | KLKB1KLK1 | |
| SCHEMBL130830 | 0.79 | L3MBTL1 (0.62) | KLKB1ALDH1A1POLB | |
| SCHEMBL16486803 | 0.79 | KLKB1 (0.48) | KLKB1KLK1HSD17B10 |
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-3309152-A1 | ISOINDOLINONE INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE | Vertex Pharmaceuticals Incorporated (US) | 2018-04-18 | — | — | EP | disclosed |