Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.55 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.52 |
| ▸ | FEN1 | P39748 | 1/20 | 0.52 |
| ▸ | CTSA | P10619 | 4/20 | 0.46 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.43 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.39 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | PAK4 | O96013 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6215832 | 0.83 | PARP10 (0.39) | KDM4CALOX5APFEN1CTSAGRM5 | |
| SCHEMBL2559099 | 0.81 | KDM4C (0.62) | KDM4CALOX5APFEN1CTSACHEK1 | |
| SCHEMBL1515697 | 0.79 | ALOX5AP (0.59) | KDM4CALOX5APFEN1CTSACHEK1 | |
| SCHEMBL9208056 | 0.76 | ALDH1A1 (0.58) | KDM4CALOX5APFEN1CHEK1TP53 | |
| SCHEMBL29466481 | 0.76 | HTT (0.57) | KDM4CALOX5APFEN1CTSACHEK1 | |
| SCHEMBL1515901 | 0.76 | HTT (0.57) | KDM4CALOX5APFEN1CTSACHEK1 | |
| SCHEMBL11781294 | 0.75 | KDM4C (0.53) | KDM4CALOX5APFEN1CTSACHEK1 | |
| SCHEMBL28493426 | 0.75 | ALDH1A1 (0.47) | ALOX5APFEN1GRM5IDO1ALDH1A1 | |
| SCHEMBL4745781 | 0.75 | CTSA (0.51) | KDM4CALOX5APFEN1CTSACHEK1 | |
| SCHEMBL29354773 | 0.74 | ADORA2B (0.40) | PARP10PARP11PDE10AIDO1MAP4K4 |
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-1899370-A1 | A CRYSTAL STRUCTURE AND USES THEREOF | MONASH UNIVERSITY (AU) | 2008-03-19 | — | — | EP | disclosed |
| WO-2006119542-A1 | A CRYSTAL STRUCTURE AND USES THEREOF | CYTOPIA RESEARCH PTY LTD (AU) | 2006-11-16 | — | — | WO | disclosed |