Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5437352 | 0.80 | DNM1 (0.33) | DNM1 | |
| SCHEMBL8664974 | 0.79 | TSHR (0.33) | TSHRSMN1; SMN2DNM1 | |
| SCHEMBL14483842 | 0.74 | CTSK (0.40) | TSHRSMN1; SMN2CTSKDNM1 | |
| SCHEMBL8663604 | 0.73 | TSHR (0.32) | TSHR | |
| SCHEMBL4543524 | 0.73 | DNM1 (0.35) | TSHRSMN1; SMN2DNM1 | |
| SCHEMBL5432519 | 0.72 | OPRM1 (0.39) | TSHRDNM1 | |
| SCHEMBL5442791 | 0.72 | OPRM1 (0.39) | TSHRDNM1 | |
| SCHEMBL5436774 | 0.72 | OPRM1 (0.39) | TSHRDNM1 | |
| SCHEMBL5444717 | 0.72 | OPRM1 (0.39) | TSHRDNM1 | |
| SCHEMBL8661836 | 0.72 | TSHR (0.35) | TSHRDNM1 |
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-113979896-A | Sitagliptin impurity I and preparation method thereof | 浙江永太手心医药科技有限公司 | 2022-01-28 | — | — | CN | disclosed |