Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.40 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.39 |
| ▸ | CACNA1I | Q9P0X4 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NR2E1 | Q9Y466 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2714960 | 0.85 | PDCD1 (0.42) | PDCD1CD274CYP1A2KDM4EMEN1 | |
| SCHEMBL2355180 | 0.84 | ADRB2 (0.44) | CYP1A2KDM4ECACNA1GCACNA1HCACNA1I | |
| SCHEMBL7963860 | 0.83 | ALDH1A1 (0.42) | CYP1A2KDM4EACACBCACNA1GCACNA1H | |
| SCHEMBL2354192 | 0.80 | PDCD1 (0.47) | PDCD1CD274KDM4EMEN1KMT2A | |
| SCHEMBL17236435 | 0.79 | NFKB1 (0.38) | CYP1A2KDM4EMEN1KMT2ACYP2C19 | |
| SCHEMBL16958368 | 0.79 | PDCD1 (0.46) | PDCD1CD274KDM4EMEN1KMT2A | |
| SCHEMBL19121724 | 0.78 | HTR1B (0.53) | CYP1A2KDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL3903483 | 0.77 | PDCD1 (0.44) | PDCD1CD274MEN1KMT2AMAPT | |
| SCHEMBL16955136 | 0.77 | PDCD1 (0.44) | PDCD1CD274KDM4EALDH1A1MAPT | |
| SCHEMBL13744828 | 0.77 | TDP1 (0.44) | CYP1A2KDM4EACACBMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001034573-A1 | COMPOUNDS | ASTRAZENECA AB (SE) | 2001-05-17 | — | — | WO | disclosed |
| WO-2001034578-A1 | COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY | ASTRAZENECA AB (SE) | 2001-05-17 | — | — | WO | disclosed |