Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 3/20 | 0.39 |
| ▸ | ITGB7 | P26010 | 3/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP7 | P09237 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.37 |
| ▸ | ITGAV | P06756 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.36 |
| ▸ | HTRA1 | Q92743 | 4/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.35 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | STS | P08842 | 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 | |
|---|---|---|---|---|
| SCHEMBL4044539 | 0.94 | ITGA4 (0.36) | ITGA4ITGB7HDAC8ELANECTSK | |
| SCHEMBL4049324 | 0.93 | MC4R (0.37) | ITGA4ITGB7ITGB3ITGAVELANE | |
| SCHEMBL4045311 | 0.90 | CTSK (0.43) | MMP1MMP2MMP3MMP7MMP9 | |
| SCHEMBL4046932 | 0.89 | GPR132 (0.35) | ITGA4ITGB7ITGB3ITGAVHDAC8 | |
| SCHEMBL4043139 | 0.89 | ELANE (0.37) | ITGA4ITGB7MMP1MMP2MMP3 | |
| SCHEMBL4045511 | 0.89 | F2 (0.38) | ITGA4ITGB7MMP8MMP13ITGB3 | |
| SCHEMBL4045924 | 0.88 | USP30 (0.40) | ITGA4ITGB7ITGB3ITGAVHDAC8 | |
| SCHEMBL4039691 | 0.86 | CTSK (0.50) | USP30HTRA1CTSKALDH1A1STS | |
| SCHEMBL4038911 | 0.85 | DPP4 (0.43) | HDAC8ALDH1A1GAASTS | |
| SCHEMBL4041003 | 0.85 | CTSL (0.39) | 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 |