Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.30 |
| ▸ | MPL | P40238 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17201564 | 0.83 | CES1 (0.46) | HDAC4CES1KDM4E | |
| SCHEMBL17204976 | 0.82 | CDC7 (0.36) | CTSSCTSKLIMK1KDM4E | |
| Trifluoroacetic Acid SCHEMBL17205294 | 0.80 | CES1 (0.35) | CTSSCTSKLIMK1HDAC4CES1 | |
| SCHEMBL17201544 | 0.80 | AAK1 (0.36) | CTSSCTSKLIMK1CES1KDM4E | |
| SCHEMBL17205108 | 0.79 | ALDH1A1 (0.37) | CTSSCTSKLIMK1CES1GABRA5 | |
| SCHEMBL17212195 | 0.76 | CES1 (0.39) | CTSSCTSKHDAC4CES1KDM4E | |
| SCHEMBL27742141 | 0.73 | P2RX7 (0.45) | — | |
| SCHEMBL17201526 | 0.72 | HSD17B1 (0.34) | CTSSCTSKHDAC4 | |
| SCHEMBL17201559 | 0.72 | CTSS (0.35) | CTSSCTSKHDAC4 | |
| SCHEMBL17201550 | 0.71 | CDC7 (0.44) | CTSSCTSKHDAC4CYP2D6 |
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-3134414-A1 | 3-OXO-TETRAHYDRO-FURO[3,2-B]PYRROL-4(5H)-YL) DERIVATIVES II | Grünenthal GmbH (DE) | 2017-03-01 | — | — | EP | disclosed |
| WO-2015161924-A1 | 3-OXO-TETRAHYDRO-FURO[3,2-B]PYRROL-4(5H)-YL) DERIVATIVES II | Grünenthal GmbH (DE) | 2015-10-29 | — | — | WO | disclosed |