Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 15/20 | 0.46 |
| ▸ | MAP4K1 | Q92918 | 6/20 | 0.46 |
| ▸ | KLK1 | P06870 | 9/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | MYLK4 | Q86YV6 | 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 | |
|---|---|---|---|---|
| SCHEMBL17442588 | 0.82 | KLKB1 (0.64) | KLKB1MAP4K1 | |
| SCHEMBL16881106 | 0.72 | KLKB1 (0.51) | KLKB1MAP4K1 | |
| SCHEMBL23279823 | 0.66 | KLKB1 (0.56) | KLKB1MAP4K1KLK1 | |
| SCHEMBL28105758 | 0.66 | KLKB1 (0.46) | KLKB1MAP4K1ROCK2 | |
| SCHEMBL17442609 | 0.64 | KLKB1 (0.66) | KLKB1MAP4K1 | |
| SCHEMBL17442642 | 0.63 | KLKB1 (1.00) | KLKB1MAP4K1KLK1 | |
| SCHEMBL18369955 | 0.62 | KLKB1 (0.84) | KLKB1MAP4K1KLK1 | |
| SCHEMBL1599428 | 0.61 | HDAC1 (0.64) | KLKB1MAP4K1 | |
| SCHEMBL19354910 | 0.60 | KLKB1 (0.62) | KLKB1MAP4K1 | |
| SCHEMBL13957326 | 0.59 | SLC7A5 (0.53) | ROCK2ROCK1MYLK4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107072985-A | Therapeutic inhibiting compound | 莱福斯希医药公司 | 2017-08-18 | — | — | CN | disclosed |