Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL31428582 | 0.86 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL9907539 | 0.86 | ALDH1A1 (0.60) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL9907331 | 0.78 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL9907540 | 0.77 | HTR5A (0.51) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL9909163 | 0.77 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL9709865 | 0.76 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL6201906 | 0.75 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL9907605 | 0.75 | ALDH1A1 (0.66) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL538292 | 0.74 | ALDH1A1 (0.57) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL14378324 | 0.73 | ALDH1A1 (0.60) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992022533-A1 | 4-AMINOQUINOLINES AND PHARMACEUTICAL COMPOSITIONS THEREOF | THE UPJOHN COMPANY (US) | 1992-12-23 | — | — | WO | disclosed |