Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 6/20 | 0.45 |
| ▸ | THRB | P10828 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.42 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2653996 | 0.93 | SMN1; SMN2 (0.51) | ALDH1A1MAPTTHRBTP53MEN1 | |
| SCHEMBL2654506 | 0.90 | ALDH1A1 (0.48) | ALDH1A1MAPTTHRBTP53MEN1 | |
| SCHEMBL2655900 | 0.84 | CSNK2A2 (0.44) | ALDH1A1MAPTTP53MEN1KMT2A | |
| SCHEMBL4677770 | 0.82 | LCK (0.47) | ALDH1A1MAPTMEN1KMT2AKDM4E | |
| SCHEMBL1792159 | 0.80 | CSNK2A2 (0.49) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL2655552 | 0.76 | ALDH1A1 (0.57) | ALDH1A1MAPTMEN1KMT2ANPC1 | |
| SCHEMBL4682128 | 0.75 | NPC1 (0.52) | ALDH1A1MAPTTHRBMEN1KMT2A | |
| SCHEMBL4678263 | 0.75 | ALDH1A1 (0.50) | ALDH1A1MAPTMEN1KMT2ANPC1 | |
| SCHEMBL2653449 | 0.74 | GCK (0.63) | ALDH1A1MAPTTP53MEN1KMT2A | |
| SCHEMBL4679400 | 0.74 | NR4A2 (0.49) | ALDH1A1MAPTTP53MEN1KMT2A |
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-1583532-B1 | QUINOLINE DERIVATIVES AS GLUCOKINASE LIGANDS | ASTRAZENECA AB (SE) | 2008-07-16 | — | — | EP | disclosed |