Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | ELOVL6 | Q9H5J4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PREP | P48147 | 1/20 | 0.34 |
| ▸ | FAP | Q12884 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NR2F2 | P24468 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4044730 | 0.93 | LMNA (0.39) | ALDH1A1ELOVL6TSHRKCNQ1HSD17B10 | |
| SCHEMBL4045961 | 0.93 | CTSK (0.39) | ALDH1A1ELOVL6TSHRKCNQ1HSD17B10 | |
| SCHEMBL4043292 | 0.91 | ALDH1A1 (0.37) | ALDH1A1PREPFAPLMNACHRM1 | |
| SCHEMBL4044339 | 0.90 | ALDH1A1 (0.37) | ALDH1A1PREPFAPLMNANR2F2 | |
| SCHEMBL4047431 | 0.90 | ALDH1A1 (0.37) | ALDH1A1KMT2APREPFAPNR2F2 | |
| SCHEMBL4046799 | 0.89 | ALDH1A1 (0.39) | ALDH1A1ELOVL6PREPFAP | |
| SCHEMBL4048312 | 0.88 | KCNQ1 (0.40) | ALDH1A1ELOVL6TSHRKCNQ1HSD17B10 | |
| SCHEMBL4050093 | 0.87 | HTT (0.41) | ALDH1A1ELOVL6TSHRKCNQ1HSD17B10 | |
| SCHEMBL4043678 | 0.86 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2PREPFAPLMNA | |
| SCHEMBL4039771 | 0.86 | ALDH1A1 (0.38) | ALDH1A1PREPFAPGAAMAPT |
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 |