Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 2/20 | 0.36 |
| ▸ | PLAU | P00749 | 2/20 | 0.36 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.34 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.34 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.34 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | GHSR | Q92847 | 1/20 | 0.31 |
| ▸ | F3 | P13726 | 2/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | F10 | P00742 | 1/20 | 0.30 |
| ▸ | F7 | P08709 | 1/20 | 0.30 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1660196 | 0.80 | PTGS1 (0.45) | KLKB1PLGPLAUCASP1PFKFB3 | |
| SCHEMBL12604678 | 0.79 | KLKB1 (0.51) | KLKB1PLGPLAURORCSMN1; SMN2 | |
| SCHEMBL1988531 | 0.79 | KLKB1 (0.43) | KLKB1SMN1; SMN2 | |
| SCHEMBL12563269 | 0.78 | KLKB1 (0.49) | KLKB1PLGPLAUFFAR1RORC | |
| SCHEMBL1661398 | 0.73 | KLKB1 (0.39) | KLKB1CA2CA1SMN1; SMN2 | |
| SCHEMBL2878994 | 0.71 | PTGS1 (0.40) | KLKB1FFAR1PFKFB3P2RX3PTGS1 | |
| SCHEMBL12603590 | 0.71 | KCNQ3 (0.41) | KLKB1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL1986290 | 0.71 | KCNQ3 (0.41) | KLKB1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL12563259 | 0.69 | KLKB1 (0.40) | KLKB1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL2880398 | 0.69 | MCL1 (0.46) | KLKB1PTGS1F10F2KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2307394-A2 | NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | Amorepacific Corporation (KR) | 2011-04-13 | — | — | EP | disclosed |
| WO-2010002209-A2 | NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | AMOREPACIFIC CORPORATION (KR) | 2010-01-07 | — | — | WO | disclosed |