Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 18/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KLK1 | P06870 | 2/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28869739 | 0.81 | KLKB1 (0.36) | KLKB1POLBNPSR1KLK1 | |
| SCHEMBL29437752 | 0.80 | POLB (0.45) | KLKB1POLBNPSR1KLK1ROCK2 | |
| SCHEMBL28825963 | 0.79 | KLKB1 (0.38) | KLKB1KLK1 | |
| SCHEMBL28047241 | 0.78 | NOS2 (0.33) | ROCK2 | |
| SCHEMBL28787513 | 0.78 | ROCK1 (0.37) | ROCK2 | |
| SCHEMBL27972554 | 0.78 | ROCK2 (0.41) | ROCK2 | |
| SCHEMBL27545407 | 0.76 | FFAR1 (0.38) | — | |
| SCHEMBL28868753 | 0.73 | LDHA (0.41) | POLBROCK2 | |
| SCHEMBL27809130 | 0.72 | ALDH1A1 (0.35) | — | |
| SCHEMBL28832869 | 0.72 | FDPS (0.38) | ROCK2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105143201-B | Benzyl amine derivative | 卡尔维斯塔制药有限公司 | 2019-02-22 | — | — | CN | disclosed |
| CN-105452240-A | Heterocyclic derivates | KALVISTA PHARMACEUTICALS LTD | 2016-03-30 | — | — | CN | disclosed |
| CN-105143201-A | Benzylamine derivatives | KALVISTA PHARMACEUTICALS LTD | 2015-12-09 | — | — | CN | disclosed |