Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.37 |
| ▸ | METAP2 | P50579 | 5/20 | 0.36 |
| ▸ | METAP1 | P53582 | 5/20 | 0.36 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.34 |
| ▸ | ANPEP | P15144 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | SLC7A11 | Q9UPY5 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18090960 | 1.00 | TSHR (0.43) | TSHRRNPEPMETAP2METAP1SLC7A5 | |
| SCHEMBL18090982 | 1.00 | TSHR (0.43) | TSHRRNPEPMETAP2METAP1SLC7A5 | |
| Hydrochloric Acid SCHEMBL28497858 | 0.98 | TSHR (0.41) | TSHRRNPEPMETAP2METAP1SLC7A5 | |
| Hydrochloric Acid SCHEMBL28497859 | 0.98 | TSHR (0.41) | TSHRRNPEPMETAP2METAP1SLC7A5 | |
| Hydrochloric Acid SCHEMBL28511725 | 0.98 | TSHR (0.41) | TSHRRNPEPMETAP2METAP1SLC7A5 | |
| SCHEMBL5848331 | 0.82 | METAP2 (0.50) | TSHRRNPEPMETAP2METAP1ANPEP | |
| SCHEMBL8650091 | 0.77 | — | — | |
| SCHEMBL8650209 | 0.77 | — | — | |
| SCHEMBL4992004 | 0.74 | — | — | |
| SCHEMBL110459 | 0.74 | — | — |
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-107428768-B | Bicyclic pyridine compound | 安斯泰来制药株式会社 | 2020-09-18 | — | — | CN | disclosed |