Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| SCHEMBL27920972 | 0.85 | NAAA (0.40) | NAAACYP2C19HTTSMN1; SMN2CYP19A1 | |
| Hydrochloric Acid SCHEMBL28770723 | 0.84 | NAAA (0.39) | NAAAALDH1A1CYP2C19HTTSMN1; SMN2 | |
| SCHEMBL8059341 | 0.84 | NAAA (0.50) | NAAAALDH1A1CYP2C19SMN1; SMN2CYP19A1 | |
| SCHEMBL16837528 | 0.83 | NAAA (0.46) | NAAAALDH1A1CYP2C19HTTSMN1; SMN2 | |
| SCHEMBL8690677 | 0.82 | — | — | |
| SCHEMBL21555532 | 0.81 | NAAA (0.45) | NAAAALDH1A1CYP2C19CYP19A1TSHR | |
| SCHEMBL1695592 | 0.79 | NAAA (0.72) | NAAAALDH1A1CYP2C19HTTSMN1; SMN2 | |
| SCHEMBL2433610 | 0.79 | NAAA (0.67) | NAAAALDH1A1CYP2C19HTTSMN1; SMN2 | |
| SCHEMBL20954656 | 0.79 | MGAM (0.39) | NAAACYP2C19HTTSMN1; SMN2EPHX1 | |
| SCHEMBL7815359 | 0.78 | NAAA (0.51) | NAAAALDH1A1HTTSMN1; SMN2CYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105517574-B | The combination product of hepatitis C virus inhibitors | 百时美施贵宝公司 | 2019-01-18 | — | — | CN | disclosed |