Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.34 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7994276 | 0.97 | ALDH1A1 (0.36) | ALDH1A1LMNAMAPK1HPGDALOX15 | |
| SCHEMBL8001769 | 0.85 | GRM2 (0.38) | ALDH1A1LMNAMAPK1HPGDALOX15 | |
| SCHEMBL7998204 | 0.83 | GRM2 (0.41) | ALDH1A1LMNAMAPK1HPGDALOX15 | |
| SCHEMBL7997626 | 0.82 | LMNA (0.39) | ALDH1A1LMNAMAPK1HPGDALOX15 | |
| SCHEMBL7994931 | 0.81 | HTR7 (0.34) | ALDH1A1LMNAMAPK1HPGDALOX15 | |
| SCHEMBL8002275 | 0.78 | ALDH1A1 (0.49) | ALDH1A1LMNAMAPK1HPGDTSHR | |
| SCHEMBL8001947 | 0.77 | GFER (0.39) | ALDH1A1LMNAGFERMEN1KMT2A | |
| SCHEMBL7996100 | 0.71 | HTR1B (0.42) | ALDH1A1LMNAMAPK1HPGDALOX15 | |
| SCHEMBL7994182 | 0.69 | KMT2A (0.40) | ALDH1A1LMNAMAPK1HPGDALOX15 | |
| SCHEMBL7994293 | 0.69 | NPC1 (0.42) | ALDH1A1LMNAMAPK1HPGDALOX15 |
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-2001034578-A1 | COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY | ASTRAZENECA AB (SE) | 2001-05-17 | — | — | WO | disclosed |