Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.30 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | MMP12 | P39900 | 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 | |
|---|---|---|---|---|
| SCHEMBL203518 | 0.90 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| SCHEMBL20680488 | 0.87 | ALDH1A1 (0.41) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| Ethylene SCHEMBL27488666 | 0.84 | ALDH1A1 (0.39) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| Fluoromethane SCHEMBL28191693 | 0.84 | ALDH1A1 (0.39) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| Trimethylammonium SCHEMBL5391194 | 0.81 | ALDH1A1 (0.37) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| Tetramethylammonium Ion SCHEMBL5398916 | 0.81 | ALDH1A1 (0.37) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| Dimethylamine SCHEMBL5398096 | 0.79 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL28253061 | 0.77 | ALDH1A1 (0.39) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| SCHEMBL9007767 | 0.75 | ALDH1A1 (0.44) | ALDH1A1TSHRHSD17B10LMNATDP1 | |
| SCHEMBL9753183 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7276615-B2 | Organofunctional surface-modified metal oxides | WACKER CHEMIE AG (DE) | 2007-10-02 | — | — | US | disclosed |
| US-20040220419-A1 | Organofunctional surface-modified metal oxides | WACKER-CHEMIE GMBH (DE) | 2004-11-04 | — | — | US | disclosed |