Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.31 |
| ▸ | CBFB | Q13951 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6606317 | 0.75 | KDM4E (0.38) | KDM4EMAPK1HSD17B10LMNAL3MBTL1 | |
| SCHEMBL6408016 | 0.72 | KDM4E (0.35) | KDM4EMAPK1HSD17B10LMNAL3MBTL1 | |
| SCHEMBL6605887 | 0.72 | KDM4E (0.35) | KDM4EMAPK1HSD17B10LMNAL3MBTL1 | |
| SCHEMBL6409426 | 0.72 | KDM4E (0.35) | KDM4EMAPK1HSD17B10LMNAL3MBTL1 | |
| SCHEMBL6402519 | 0.65 | KDM4E (0.41) | KDM4EMAPK1HSD17B10LMNAL3MBTL1 | |
| SCHEMBL8371644 | 0.64 | ESR1 (0.35) | KDM4EMAPK1HSD17B10LMNAL3MBTL1 | |
| SCHEMBL3210010 | 0.62 | CRHR1 (0.44) | KDM4EMAPK1HSD17B10LMNAL3MBTL1 | |
| SCHEMBL15834811 | 0.62 | ALDH1A1 (0.41) | ALDH1A1MAPT | |
| SCHEMBL11479180 | 0.60 | ALDH1A1 (0.50) | KDM4EMAPK1HSD17B10L3MBTL1ALDH1A1 | |
| SCHEMBL20696789 | 0.57 | S1PR4 (0.38) | KDM4EMAPK1HSD17B10LMNAL3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1411933-A1 | ALPHA-KETOAMIDE DERIVATIVES AS CATHEPSIN K INHIBITORS | SmithKline Beecham Corporation (US) | 2004-04-28 | — | — | EP | disclosed |
| WO-2003013518-A1 | ALPHA-KETOAMIDE DERIVATIVES AS CATHEPSIN K INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-02-20 | — | — | WO | disclosed |