Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | XDH | P47989 | 2/20 | 0.48 |
| ▸ | CDK4 | P11802 | 3/20 | 0.42 |
| ▸ | CCND1 | P24385 | 3/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.42 |
| ▸ | CDK1 | P06493 | 2/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.42 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.42 |
| ▸ | APP | P05067 | 5/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.35 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1310214 | 0.87 | ALDH1A1 (0.75) | ALDH1A1KDM4EMAPTTRPA1LMNA | |
| SCHEMBL1310216 | 0.87 | ALDH1A1 (0.75) | ALDH1A1KDM4EMAPTTRPA1LMNA | |
| SCHEMBL15624492 | 0.80 | ALDH1A1 (0.60) | ALDH1A1KDM4EMAPTTRPA1LMNA | |
| SCHEMBL1308773 | 0.79 | ALDH1A1 (0.65) | ALDH1A1KDM4EMAPTTRPA1LMNA | |
| SCHEMBL1308775 | 0.79 | ALDH1A1 (0.65) | ALDH1A1KDM4EMAPTTRPA1LMNA | |
| SCHEMBL4623252 | 0.77 | ALDH1A1 (0.62) | ALDH1A1KDM4EMAPTTRPA1LMNA | |
| SCHEMBL4623249 | 0.77 | ALDH1A1 (0.62) | ALDH1A1KDM4EMAPTTRPA1LMNA | |
| SCHEMBL431858 | 0.75 | ALDH1A1 (0.60) | ALDH1A1KDM4EMAPTTRPA1LMNA | |
| SCHEMBL566332 | 0.75 | ALDH1A1 (0.60) | ALDH1A1KDM4EMAPTTRPA1LMNA | |
| SCHEMBL22306664 | 0.75 | ALDH1A1 (0.60) | ALDH1A1KDM4EMAPTTRPA1LMNA |
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-1611189-B1 | POLYMERISED LIQUID CRYSTAL FILM WITH RETARDATION OR ORIENTATION PATTERN | MERCK PATENT GMBH (DE) | 2014-03-26 | — | — | EP | disclosed |