Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TYR | P14679 | 1/20 | 0.44 |
| ▸ | GRIA4 | P48058 | 4/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | PDE2A | O00408 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20804428 | 1.00 | TSHR (0.52) | TSHRLMNATYRGRIA4NR1H4 | |
| SCHEMBL9621026 | 0.79 | TSHR (0.50) | TSHRLMNATYRGRIA4NR1H4 | |
| SCHEMBL548066 | 0.79 | TSHR (0.50) | TSHRLMNATYRGRIA4NR1H4 | |
| SCHEMBL28479739 | 0.78 | PDE2A (0.50) | TSHRKIF11PDE2AALDH1A1AKR1C3 | |
| SCHEMBL292572 | 0.76 | TSHR (0.52) | TSHRLMNATYRGRIA4NR1H4 | |
| SCHEMBL24209319 | 0.75 | PDE2A (0.63) | TSHRLMNATYRGRIA4NR1H4 | |
| SCHEMBL18282984 | 0.75 | LMNA (0.50) | TSHRLMNATYRGRIA4NR1H4 | |
| SCHEMBL2644008 | 0.75 | LMNA (0.50) | TSHRLMNATYRGRIA4NR1H4 | |
| SCHEMBL17722885 | 0.75 | TSHR (0.46) | TSHRLMNATYRGRIA4NR1H4 | |
| SCHEMBL12241427 | 0.75 | TSHR (0.46) | TSHRLMNATYRGRIA4NR1H4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112174995-B | Double-silicon compound, preparation method and application thereof | 武汉大学 | 2021-12-03 | — | — | CN | disclosed |
| CN-112174995-A | Double-silicon compound, preparation method and application thereof | 武汉大学 | 2021-01-05 | — | — | CN | disclosed |