Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | ELOVL6 | Q9H5J4 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 2/20 | 0.33 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4049190 | 0.92 | CTSK (0.40) | HSD17B10HCRTR2KCNQ1GAAELOVL6 | |
| SCHEMBL4050153 | 0.89 | SMYD3 (0.35) | TSHRSMYD3ALDH1A1MAPT | |
| SCHEMBL4050322 | 0.89 | CTSK (0.34) | CTSKALDH1A1 | |
| SCHEMBL4043056 | 0.89 | HSD17B10 (0.36) | HSD17B10HCRTR2KCNQ1GAAELOVL6 | |
| SCHEMBL4045505 | 0.89 | KCNQ1 (0.38) | HSD17B10HCRTR2KCNQ1GAAELOVL6 | |
| SCHEMBL4039018 | 0.87 | HSD17B10 (0.36) | HSD17B10HCRTR2KCNQ1GAAELOVL6 | |
| SCHEMBL4051650 | 0.87 | HSD17B10 (0.36) | HSD17B10HCRTR2KCNQ1GAAELOVL6 | |
| SCHEMBL4048312 | 0.87 | KCNQ1 (0.40) | HSD17B10KCNQ1GAAELOVL6ATM | |
| SCHEMBL4046913 | 0.86 | HSD17B10 (0.38) | HSD17B10HCRTR2KCNQ1GAAELOVL6 | |
| SCHEMBL4047847 | 0.86 | CTSK (0.38) | CTSK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1546150-B1 | PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES | AMURA THERAPEUTICS LTD (GB) | 2009-03-04 | — | — | EP | claimed |