Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 3/20 | 0.64 |
| ▸ | KLK7 | P49862 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7801726 | 1.00 | HDAC2 (0.64) | HDAC2KLK7ALDH1A1MEN1KMT2A | |
| SCHEMBL6527328 | 0.87 | KLK7 (0.64) | HDAC2KLK7ALDH1A1MEN1KMT2A | |
| SCHEMBL8765027 | 0.82 | HDAC2 (0.61) | HDAC2KLK7ALDH1A1MEN1KMT2A | |
| SCHEMBL11089899 | 0.82 | PARP1 (0.68) | HDAC2KLK7ALDH1A1MEN1KMT2A | |
| SCHEMBL8153169 | 0.81 | HDAC2 (0.76) | HDAC2KLK7ALDH1A1MAPTPARP1 | |
| SCHEMBL3585103 | 0.81 | HDAC2 (0.76) | HDAC2KLK7PARP1PARP10LMNA | |
| SCHEMBL3585099 | 0.81 | HDAC2 (0.76) | HDAC2KLK7PARP1PARP10LMNA | |
| SCHEMBL13345388 | 0.81 | HDAC2 (0.57) | HDAC2KLK7ALDH1A1MEN1KMT2A | |
| SCHEMBL29006058 | 0.81 | HDAC2 (0.57) | HDAC2KLK7ALDH1A1MEN1KMT2A | |
| SCHEMBL3591282 | 0.80 | HDAC2 (0.77) | HDAC2KLK7LMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1537074-A1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA INC. (CA) | 2005-06-08 | — | — | EP | disclosed |
| WO-2004022526-A1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 2004-03-18 | — | — | WO | disclosed |
| EP-1163206-A1 | METHOD FOR HYDROLYZING OPTICALLY ACTIVE AMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2001-12-19 | — | — | EP | disclosed |
| WO-2000056699-A1 | METHOD FOR HYDROLYZING OPTICALLY ACTIVE AMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2000-09-28 | — | — | WO | disclosed |