Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 15/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | PDE2A | O00408 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | AADAT | Q8N5Z0 | 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 | |
|---|---|---|---|---|
| SCHEMBL19002060 | 0.86 | PDE2A (0.44) | KLKB1ALDH1A1TSHRPDE2AKCNH2 | |
| SCHEMBL18097766 | 0.82 | TSHR (0.55) | KLKB1ALDH1A1TSHRAADAT | |
| SCHEMBL8532606 | 0.82 | ALDH1A1 (0.48) | KLKB1ALDH1A1TSHRKCNH2AADAT | |
| SCHEMBL13254189 | 0.81 | MEN1 (0.55) | KLKB1ALDH1A1 | |
| SCHEMBL21503349 | 0.81 | KLKB1 (0.45) | KLKB1ALDH1A1TSHRKCNH2AADAT | |
| Hydrochloric Acid SCHEMBL28525601 | 0.81 | KLKB1 (0.46) | KLKB1ALDH1A1TSHRPDE2AKCNH2 | |
| Hydrochloric Acid SCHEMBL21491618 | 0.80 | KLKB1 (0.45) | KLKB1ALDH1A1TSHRKCNH2AADAT | |
| SCHEMBL2819900 | 0.79 | KLKB1 (0.56) | KLKB1ALDH1A1TSHRPDE2A | |
| SCHEMBL17232474 | 0.79 | KLKB1 (0.49) | KLKB1TSHR | |
| SCHEMBL15759268 | 0.79 | KLKB1 (0.51) | KLKB1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017103615-A1 | COMBINATION PRODUCT | LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) | 2017-06-22 | — | — | WO | disclosed |