Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 7/20 | 0.39 |
| ▸ | ITGB7 | P26010 | 7/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.38 |
| ▸ | ITGAV | P06756 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ECE1 | P42892 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4049549 | 0.94 | GPR132 (0.38) | ITGA4ITGB7CTSKECE1CHRNA7 | |
| SCHEMBL4040214 | 0.93 | GPR132 (0.39) | ITGA4ITGB7CTSKKLKB1ECE1 | |
| SCHEMBL4045083 | 0.90 | CTSK (0.47) | CTSKCHRNA7 | |
| SCHEMBL4042165 | 0.90 | EPHX1 (0.37) | CTSKECE1CHRNA7ACE | |
| SCHEMBL4047771 | 0.89 | CTSK (0.39) | CTSKECE1CHRNA7 | |
| SCHEMBL4045511 | 0.87 | F2 (0.38) | ITGA4ITGB7CTSKITGB3ITGAV | |
| SCHEMBL4044931 | 0.85 | CTSK (0.54) | CTSKF2MAPTALDH1A1GAA | |
| SCHEMBL4042585 | 0.84 | USP30 (0.39) | ITGA4ITGB7CTSKITGB3ITGAV | |
| SCHEMBL4041556 | 0.84 | CTSK (0.43) | ITGA4ITGB7CTSKITGB3ITGAV | |
| SCHEMBL4043904 | 0.84 | DPP4 (0.44) | F2MAPTALDH1A1CHRNA7 |
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 |