Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 5/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 11/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL28111673 | 0.87 | ACACB (0.35) | ACACBKLKB1 | |
| SCHEMBL28111162 | 0.87 | ACACB (0.37) | ACACBKLKB1 | |
| SCHEMBL17064969 | 0.83 | KLKB1 (0.39) | KLKB1 | |
| SCHEMBL17064972 | 0.81 | GLA (0.41) | KLKB1CCR5 | |
| SCHEMBL23429072 | 0.79 | ADRB1 (0.35) | KLKB1ADRB1ADRA2AADRB3ADRA2B | |
| SCHEMBL28534568 | 0.74 | ALDH1A1 (0.39) | CCR5ADRB1ADRA2AADRB3ADRA2B | |
| SCHEMBL25668311 | 0.74 | ADRB1 (0.38) | CCR5ADRB1ADRA2AADRB3ADRA2B | |
| SCHEMBL22394359 | 0.72 | ADRB1 (0.35) | CCR5ADRB1ADRA2AADRB3ADRA2B | |
| SCHEMBL17064475 | 0.72 | ADRB1 (0.35) | CCR5ADRB1ADRA2AADRB3ADRA2B | |
| SCHEMBL28938019 | 0.71 | KLKB1 (0.54) | KLKB1 |
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-106257976-A | Human plasma kallikrein inhibitors | 拜奥克里斯特制药公司 | 2016-12-28 | — | — | CN | disclosed |