Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 2/20 | 0.39 |
| ▸ | CEL | P19835 | 2/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | JAK1 | P23458 | 1/20 | 0.31 |
| ▸ | TYK2 | P29597 | 1/20 | 0.31 |
| ▸ | JAK3 | P52333 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7991193 | 0.97 | TDO2 (0.37) | TDO2CEL | |
| SCHEMBL15243172 | 0.73 | TDO2 (0.43) | TDO2CELNUDT1BACE1HSP90AA1 | |
| SCHEMBL42781 | 0.69 | PTGDR2 (0.48) | TDO2CELPTGDR2CYP11B2PTGS2 | |
| SCHEMBL1087151 | 0.67 | KDM4E (0.49) | TDO2NUDT1BACE1HSP90AA1KDM4E | |
| SCHEMBL143816 | 0.67 | TDO2 (0.39) | TDO2CELNUDT1BACE1HSP90AA1 | |
| SCHEMBL22732970 | 0.67 | DAO (0.50) | TDO2CELHSP90AA1KDM4EMEN1 | |
| SCHEMBL9804702 | 0.65 | ESR1 (0.41) | TDO2NUDT1BACE1HSP90AA1KDM4E | |
| Hydrogen Peroxide SCHEMBL3679819 | 0.65 | PTGDR2 (0.55) | CELKDM4EMEN1KMT2APTGDR2 | |
| Hydrogen Peroxide SCHEMBL11398422 | 0.65 | PTGDR2 (0.55) | CELKDM4EMEN1KMT2APTGDR2 | |
| SCHEMBL7760634 | 0.65 | NUDT1 (0.52) | TDO2CELNUDT1BACE1HSP90AA1 |
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-6197922-B1 | ELECTROCHEMICAL POLYMERIZATION USING PALLADIUM COMPLEX CATALYST; STILLE AND SUZUKI REACTIONS | BASF AKTIENGESELLSCHAFT (DE) | 2001-03-06 | — | — | US | disclosed |
| EP-0902043-A2 | Polyselenophenes, process for their preparation, and their use | BASF AKTIENGESELLSCHAFT (DE) | 1999-03-17 | — | — | EP | disclosed |