Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CDC25B | P30305 | 2/20 | 0.41 |
| ▸ | S100A4 | P26447 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7977530 | 0.83 | HSD17B10 (0.54) | CYP1A2PDCD1CD274ALDH1A1KDM4E | |
| SCHEMBL1661817 | 0.81 | CYP1A2 (0.53) | CYP1A2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL8179309 | 0.78 | CYP1A2 (0.69) | CYP1A2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL351155 | 0.78 | CYP1A2 (0.50) | CYP1A2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL7994077 | 0.77 | PDCD1 (0.46) | CYP1A2PDCD1CD274ALDH1A1KDM4E | |
| SCHEMBL7997433 | 0.77 | ALDH1A1 (0.52) | ALDH1A1KDM4EHPGDHSD17B10MAPT | |
| SCHEMBL27233202 | 0.76 | CYP1A2 (0.60) | CYP1A2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL21328440 | 0.75 | CYP1A2 (0.59) | CYP1A2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL10424596 | 0.75 | CYP1A2 (0.59) | CYP1A2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL16957698 | 0.74 | PDCD1 (0.50) | PDCD1CD274ALDH1A1MAPTSMN1; SMN2 |
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 |