Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADCY5 | O95622 | 11/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | FDPS | P14324 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21392942 | 0.81 | ADCY5 (0.44) | ADCY5CYP1A2CYP3A4FDPSALDH1A1 | |
| SCHEMBL21393219 | 0.78 | ADCY5 (0.44) | ADCY5CYP1A2CYP3A4FDPSALDH1A1 | |
| SCHEMBL21393211 | 0.78 | ALDH1A1 (0.40) | CYP1A2CYP3A4NFKB1THPOBLM | |
| SCHEMBL26212473 | 0.76 | DNMT3B (0.37) | FDPSHDAC1HDAC6DNMT3B | |
| SCHEMBL19553770 | 0.75 | ADORA2A (0.49) | CYP1A2CYP3A4NFKB1THPOBLM | |
| SCHEMBL21392946 | 0.74 | FDPS (0.40) | ADCY5CYP1A2CYP3A4FDPSALDH1A1 | |
| Hydrochloric Acid SCHEMBL7659251 | 0.73 | ABL1 (0.39) | ADCY5CYP1A2CYP3A4FDPSALDH1A1 | |
| Hydrochloric Acid SCHEMBL7659256 | 0.73 | ABL1 (0.39) | ADCY5CYP1A2CYP3A4FDPSALDH1A1 | |
| Hydrochloric Acid SCHEMBL7659259 | 0.73 | ABL1 (0.39) | ADCY5CYP1A2CYP3A4FDPSALDH1A1 | |
| Hydrochloric Acid SCHEMBL7843046 | 0.73 | ABL1 (0.39) | ADCY5CYP1A2CYP3A4FDPSALDH1A1 |
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-2019180683-A1 | STING MODULATOR COMPOUNDS WITH SULFAMATE LINKAGES, AND METHODS OF MAKING AND USING | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2019-09-26 | — | — | WO | disclosed |