Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CD44 | P16070 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ATP4A | P20648 | 1/20 | 0.33 |
| ▸ | ATP4B | P51164 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8601665 | 0.77 | CD44 (0.41) | ALDH1A1HTTL3MBTL1CD44KDM4E | |
| SCHEMBL6338911 | 0.74 | CD44 (0.45) | ALDH1A1HTTL3MBTL1CD44KDM4E | |
| SCHEMBL9752241 | 0.73 | RAD52 (0.48) | ALDH1A1HTTL3MBTL1CD44KDM4E | |
| SCHEMBL19229591 | 0.73 | MTNR1A (0.41) | ALDH1A1HTTL3MBTL1CD44KDM4E | |
| SCHEMBL27876812 | 0.73 | CD44 (0.43) | ALDH1A1HTTL3MBTL1CD44CYP3A4 | |
| SCHEMBL11570628 | 0.71 | CD44 (0.38) | ALDH1A1HTTL3MBTL1CD44KDM4E | |
| SCHEMBL28474465 | 0.71 | KDM4E (0.51) | ALDH1A1CD44KDM4ECYP3A4TSHR | |
| SCHEMBL10579910 | 0.70 | CD44 (0.41) | ALDH1A1HTTL3MBTL1CD44CYP3A4 | |
| SCHEMBL11781958 | 0.70 | CYP1A2 (0.41) | ALDH1A1HTTL3MBTL1CD44KDM4E | |
| SCHEMBL16410354 | 0.70 | MTNR1A (0.39) | ALDH1A1HTTL3MBTL1CD44KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-6099625-A | Ink composition | ZENECA LIMITED (GB) | 2000-08-08 | — | — | US | disclosed |
| EP-0823927-A2 | INK COMPOSITION | ZENECA LIMITED (GB) | 1998-02-18 | — | — | EP | disclosed |
| WO-1996034916-A2 | INK COMPOSITION | ZENECA LIMITED (GB) | 1996-11-07 | — | — | WO | disclosed |