Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 2/20 | 0.37 |
| ▸ | ITGAV | P06756 | 1/20 | 0.37 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.37 |
| ▸ | BCL2 | P10415 | 2/20 | 0.36 |
| ▸ | ELOVL6 | Q9H5J4 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 3/20 | 0.34 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.34 |
| ▸ | ITGA4 | P13612 | 3/20 | 0.34 |
| ▸ | ITGB7 | P26010 | 3/20 | 0.34 |
| ▸ | CTSB | P07858 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4041436 | 0.94 | ALDH1A1 (0.39) | ITGB1ITGAVKCNQ1BCL2F2 | |
| SCHEMBL4047882 | 0.93 | F2 (0.36) | ITGB1ITGAVKCNQ1BCL2ELOVL6 | |
| SCHEMBL4047615 | 0.90 | CTSB (0.38) | BCL2F2NAMPTGPR132CTSK | |
| SCHEMBL4042529 | 0.90 | BCL2 (0.38) | BCL2GPR132CTSKITGA4ITGB7 | |
| SCHEMBL4046036 | 0.89 | P2RX7 (0.36) | ITGB1BCL2CTSKITGA4ITGB7 | |
| SCHEMBL4051777 | 0.89 | CTSK (0.44) | KCNQ1ELOVL6ALDH1A1NAMPTCTSK | |
| SCHEMBL4048312 | 0.88 | KCNQ1 (0.40) | KCNQ1ELOVL6ALDH1A1NAMPTCTSK | |
| SCHEMBL4041433 | 0.88 | ALDH1A1 (0.35) | ITGB1ITGAVF2ALDH1A1ITGA4 | |
| SCHEMBL4041003 | 0.87 | CTSL (0.39) | CTSKCTSBCTSS | |
| SCHEMBL4049549 | 0.85 | GPR132 (0.38) | GPR132CTSKACE2ITGA4ITGB7 |
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 |