Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.33 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.33 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.32 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.32 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.32 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL76000 | 1.00 | TSHR (0.39) | TSHRTDP1ALDH1A1HSD17B10ESR1 | |
| SCHEMBL705847 | 0.97 | ESR1 (0.40) | TSHRTDP1ALDH1A1HSD17B10ESR1 | |
| Fluoride SCHEMBL5604818 | 0.97 | TSHR (0.37) | TSHRTDP1ALDH1A1HSD17B10ESR1 | |
| SCHEMBL9586411 | 0.91 | TSHR (0.33) | TSHRTDP1ALDH1A1HSD17B10ESR1 | |
| SCHEMBL28518241 | 0.91 | TSHR (0.33) | TSHRTDP1ALDH1A1HSD17B10ESR1 | |
| SCHEMBL23000908 | 0.86 | CYP1A2 (0.48) | TDP1ALDH1A1HSD17B10ESR2LMNA | |
| SCHEMBL5065485 | 0.86 | ESR1 (0.34) | TSHRESR1ESR2LMNAALOX12 | |
| SCHEMBL20829729 | 0.86 | TSHR (0.50) | TSHRESR1ESR2LMNANPC1 | |
| SCHEMBL6046614 | 0.86 | ALDH1A1 (0.30) | TSHRTDP1ALDH1A1ESR1ESR2 | |
| Toluene SCHEMBL28546934 | 0.86 | ACHE (0.58) | TSHRTDP1ALDH1A1ESR1ESR2 |
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-117209527-A | Method for preparing organosilane by silica powder ball milling catalysis method | 浙江大学 | 2023-12-12 | — | — | CN | disclosed |