Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.65 |
| ▸ | CHKA | P35790 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | GFER | P55789 | 1/20 | 0.55 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.55 |
| ▸ | NCF1 | P14598 | 1/20 | 0.54 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL4576894 | 0.86 | ALDH1A1 (0.57) | ALDH1A1CHKAGAAMAPTKMT2A | |
| SCHEMBL27529172 | 0.84 | ALDH1A1 (0.56) | ALDH1A1CHKAGAAMAPTKMT2A | |
| SCHEMBL3119472 | 0.82 | CHKA (0.59) | ALDH1A1CHKAGAAMAPTKMT2A | |
| SCHEMBL27606228 | 0.82 | CHKA (0.59) | ALDH1A1CHKAGAAMAPTKMT2A | |
| SCHEMBL15993967 | 0.82 | DRD2 (0.62) | ALDH1A1GAAMAPTKDM4EGFER | |
| SCHEMBL15551035 | 0.82 | TRIM24 (0.61) | ALDH1A1CHKAGAAMAPTKMT2A | |
| SCHEMBL13657312 | 0.81 | NCF1 (0.55) | ALDH1A1CHKAGAAMAPTKMT2A | |
| SCHEMBL178275 | 0.80 | ALDH1A1 (0.63) | ALDH1A1CHKAGAAMAPTKMT2A | |
| SCHEMBL6065386 | 0.80 | ALDH1A1 (0.62) | ALDH1A1CHKAGAAMAPTKMT2A | |
| SCHEMBL14058810 | 0.79 | LMNA (0.62) | ALDH1A1CHKAKDM4ENCF1NPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013171281-A1 | HYDANTOIN AND THIOHYDANTOIN DERIVATIVES AS ANTIVIRAL DRUGS | VIVALIS (FR) | 2013-11-21 | — | — | WO | disclosed |
| EP-1511742-A1 | KINASE INHIBITORS | Cytopia PTY Ltd (AU) | 2005-03-09 | — | — | EP | disclosed |
| WO-2003099811-A1 | KINASE INHIBITORS | CYTOPIA PTY LTD (AU) | 2003-12-04 | — | — | WO | disclosed |