Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | ELOVL6 | Q9H5J4 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 4/20 | 0.33 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP7 | P09237 | 1/20 | 0.32 |
| ▸ | PREP | P48147 | 1/20 | 0.32 |
| ▸ | FAP | Q12884 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL4046924 | 0.93 | CTSK (0.40) | ALDH1A1HSD17B10ELOVL6CTSKKCNQ1 | |
| SCHEMBL4039018 | 0.93 | HSD17B10 (0.36) | ALDH1A1HSD17B10ELOVL6CTSKKCNQ1 | |
| SCHEMBL4046884 | 0.91 | CTSK (0.34) | ALDH1A1CTSKCHRNB2CHRNA7CHRNA4 | |
| SCHEMBL4043813 | 0.90 | CHRNB2 (0.36) | ALDH1A1CTSKCHRNB2CHRNA7CHRNA4 | |
| SCHEMBL4040556 | 0.90 | ALDH1A1 (0.35) | ALDH1A1CTSKMMP13MMP1MMP2 | |
| SCHEMBL4045076 | 0.90 | ALDH1A1 (0.38) | ALDH1A1CTSKCTSS | |
| SCHEMBL4042306 | 0.87 | MMP8 (0.37) | ALDH1A1CTSKCHRNA7MMP13MMP1 | |
| SCHEMBL4047432 | 0.87 | ALDH1A1 (0.35) | ALDH1A1CTSKCHRNA7MMP13MMP1 | |
| SCHEMBL4051650 | 0.86 | HSD17B10 (0.36) | ALDH1A1HSD17B10ELOVL6CTSKKCNQ1 | |
| SCHEMBL4044802 | 0.86 | ALDH1A1 (0.35) | ALDH1A1CTSKMMP13MMP1MMP2 |
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 |