Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 1/20 | 0.50 |
| ▸ | ERN1 | O75460 | 1/20 | 0.50 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.50 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.43 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GGT1 | P19440 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3864807 | 0.86 | ERN1 (0.68) | TLR2ERN1TLR1TLR6MAPK1 | |
| SCHEMBL30706195 | 0.84 | PTGS2 (0.52) | MAPK1PTGS2KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL58004 | 0.84 | PTGS2 (0.52) | MAPK1PTGS2KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL2918517 | 0.83 | MAPK1 (0.56) | MAPK1PTGS2KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL3248320 | 0.83 | ACHE (0.54) | TLR2ERN1TLR1TLR6MAPK1 | |
| Benzene SCHEMBL29242020 | 0.82 | PTGS2 (0.55) | MAPK1PTGS2KDM4EHSD17B10ALDH1A1 | |
| Water SCHEMBL27837589 | 0.82 | PTGS2 (0.50) | MAPK1PTGS2KDM4EHSD17B10ALDH1A1 | |
| Ethylene SCHEMBL27547726 | 0.82 | PTGS2 (0.50) | MAPK1PTGS2KDM4EHSD17B10ALDH1A1 | |
| Methane SCHEMBL27458309 | 0.82 | PTGS2 (0.50) | MAPK1PTGS2KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL3628673 | 0.81 | HTT (0.44) | TLR2ERN1TLR1TLR6MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003062283-A1 | AN OLEFIN POLYMERISATION TITANIUM CATALYST | RELIANCE INDUSTRIES LIMITED (IN) | 2003-07-31 | — | — | WO | disclosed |