Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD44 | P16070 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ATP4A | P20648 | 1/20 | 0.39 |
| ▸ | ATP4B | P51164 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LDHA | P00338 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6338911 | 0.79 | CD44 (0.45) | CD44ALDH1A1L3MBTL1HTTATP4A | |
| SCHEMBL28474465 | 0.79 | KDM4E (0.51) | CD44ALDH1A1CYP3A4TDP1CYP2C19 | |
| SCHEMBL3722266 | 0.79 | AKR1B1 (0.48) | ALDH1A1CYP3A4CYP2C19KDM4EKMT2A | |
| SCHEMBL27876812 | 0.78 | CD44 (0.43) | CD44ALDH1A1L3MBTL1HTTATP4A | |
| SCHEMBL8020749 | 0.77 | ALDH1A1 (0.39) | CD44ALDH1A1L3MBTL1HTTATP4A | |
| SCHEMBL7315180 | 0.77 | ESR1 (0.39) | CD44ALDH1A1L3MBTL1HTTTDP1 | |
| SCHEMBL11278306 | 0.76 | CD274 (0.40) | ALDH1A1L3MBTL1HTTKDM4EHPGD | |
| SCHEMBL11273899 | 0.76 | CD274 (0.40) | ALDH1A1L3MBTL1HTTKDM4EHPGD | |
| SCHEMBL20957060 | 0.75 | CYP1A2 (0.47) | CD44ALDH1A1L3MBTL1HTTCYP3A4 | |
| SCHEMBL10579910 | 0.75 | CD44 (0.41) | CD44ALDH1A1L3MBTL1HTTATP4A |
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-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 |